id	sid	tid	token	lemma	pos
ecletica-1352	1	1	original	original	ADJ
ecletica-1352	1	2	article	article	NOUN
ecletica-1352	1	3	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	1	4	|	|	ADJ
ecletica-1352	1	5	vol	vol	NOUN
ecletica-1352	1	6	.	.	PUNCT
ecletica-1352	2	1	47	47	NUM
ecletica-1352	3	1	|	|	ADV
ecletica-1352	3	2	n.	n.	NOUN
ecletica-1352	3	3	4	4	NUM
ecletica-1352	4	1	|	|	ADV
ecletica-1352	4	2	2022	2022	NUM
ecletica-1352	5	1	|	|	ADV
ecletica-1352	5	2	37	37	NUM
ecletica-1352	5	3	eclética	eclética	PROPN
ecletica-1352	5	4	química	química	PROPN
ecletica-1352	5	5	journal	journal	PROPN
ecletica-1352	5	6	,	,	PUNCT
ecletica-1352	5	7	vol	vol	NOUN
ecletica-1352	5	8	.	.	PROPN
ecletica-1352	6	1	47	47	NUM
ecletica-1352	6	2	,	,	PUNCT
ecletica-1352	6	3	n.	n.	NOUN
ecletica-1352	6	4	4	4	NUM
ecletica-1352	6	5	,	,	PUNCT
ecletica-1352	6	6	2022	2022	NUM
ecletica-1352	6	7	,	,	PUNCT
ecletica-1352	6	8	37	37	NUM
ecletica-1352	6	9	-	-	SYM
ecletica-1352	6	10	50	50	NUM
ecletica-1352	6	11	issn	issn	NOUN
ecletica-1352	6	12	:	:	PUNCT
ecletica-1352	6	13	1678	1678	NUM
ecletica-1352	6	14	-	-	SYM
ecletica-1352	6	15	4618	4618	NUM
ecletica-1352	6	16	doi	doi	NOUN
ecletica-1352	6	17	:	:	PUNCT
ecletica-1352	6	18	10.26850/1678	10.26850/1678	NUM
ecletica-1352	6	19	-	-	PUNCT
ecletica-1352	6	20	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	6	21	-	-	PUNCT
ecletica-1352	6	22	50	50	NUM
ecletica-1352	6	23	experimental	experimental	ADJ
ecletica-1352	6	24	,	,	PUNCT
ecletica-1352	6	25	dft	dft	PROPN
ecletica-1352	6	26	,	,	PUNCT
ecletica-1352	6	27	molecular	molecular	ADJ
ecletica-1352	6	28	docking	docking	NOUN
ecletica-1352	6	29	and	and	CCONJ
ecletica-1352	6	30	in	in	ADP
ecletica-1352	6	31	silico	silico	NOUN
ecletica-1352	6	32	admet	admet	NOUN
ecletica-1352	6	33	studies	study	NOUN
ecletica-1352	6	34	of	of	ADP
ecletica-1352	6	35	cadmium	cadmium	NOUN
ecletica-1352	6	36	-	-	PUNCT
ecletica-1352	6	37	benzenetricarboxylates	benzenetricarboxylate	NOUN
ecletica-1352	6	38	enyi	enyi	NOUN
ecletica-1352	6	39	inah	inah	PROPN
ecletica-1352	6	40	bassey1	bassey1	PROPN
ecletica-1352	6	41	,	,	PUNCT
ecletica-1352	6	42	terkumbur	terkumbur	PROPN
ecletica-1352	6	43	emmanuel	emmanuel	PROPN
ecletica-1352	6	44	gber2,3	gber2,3	PROPN
ecletica-1352	6	45	+	+	PROPN
ecletica-1352	6	46	,	,	PUNCT
ecletica-1352	6	47	edison	edison	PROPN
ecletica-1352	6	48	esther	esther	PROPN
ecletica-1352	6	49	ekpenyong1	ekpenyong1	PROPN
ecletica-1352	6	50	,	,	PUNCT
ecletica-1352	6	51	henry	henry	PROPN
ecletica-1352	6	52	okon	okon	PROPN
ecletica-1352	6	53	edet3	edet3	PROPN
ecletica-1352	6	54	,	,	PUNCT
ecletica-1352	6	55	innocent	innocent	ADJ
ecletica-1352	6	56	benjamin3	benjamin3	NOUN
ecletica-1352	6	57	,	,	PUNCT
ecletica-1352	6	58	imabasi	imabasi	NOUN
ecletica-1352	6	59	tom	tom	PROPN
ecletica-1352	6	60	ita2,3	ita2,3	PROPN
ecletica-1352	6	61	1	1	NUM
ecletica-1352	6	62	.	.	PUNCT
ecletica-1352	7	1	university	university	NOUN
ecletica-1352	7	2	of	of	ADP
ecletica-1352	7	3	calabar	calabar	PROPN
ecletica-1352	7	4	,	,	PUNCT
ecletica-1352	7	5	inorganic	inorganic	ADJ
ecletica-1352	7	6	materials	material	NOUN
ecletica-1352	7	7	research	research	NOUN
ecletica-1352	7	8	laboratory	laboratory	NOUN
ecletica-1352	7	9	,	,	PUNCT
ecletica-1352	7	10	calabar	calabar	PROPN
ecletica-1352	7	11	,	,	PUNCT
ecletica-1352	7	12	nigeria	nigeria	PROPN
ecletica-1352	7	13	.	.	PUNCT
ecletica-1352	8	1	2	2	X
ecletica-1352	8	2	.	.	X
ecletica-1352	8	3	university	university	NOUN
ecletica-1352	8	4	of	of	ADP
ecletica-1352	8	5	calabar	calabar	PROPN
ecletica-1352	8	6	,	,	PUNCT
ecletica-1352	8	7	department	department	NOUN
ecletica-1352	8	8	of	of	ADP
ecletica-1352	8	9	pure	pure	ADJ
ecletica-1352	8	10	and	and	CCONJ
ecletica-1352	8	11	applied	applied	ADJ
ecletica-1352	8	12	chemistry	chemistry	NOUN
ecletica-1352	8	13	,	,	PUNCT
ecletica-1352	8	14	calabar	calabar	PROPN
ecletica-1352	8	15	,	,	PUNCT
ecletica-1352	8	16	nigeria	nigeria	PROPN
ecletica-1352	8	17	.	.	PUNCT
ecletica-1352	9	1	3	3	X
ecletica-1352	9	2	.	.	X
ecletica-1352	9	3	university	university	NOUN
ecletica-1352	9	4	of	of	ADP
ecletica-1352	9	5	calabar	calabar	PROPN
ecletica-1352	9	6	,	,	PUNCT
ecletica-1352	9	7	computational	computational	ADJ
ecletica-1352	9	8	and	and	CCONJ
ecletica-1352	9	9	bio	bio	ADJ
ecletica-1352	9	10	-	-	PUNCT
ecletica-1352	9	11	simulation	simulation	PROPN
ecletica-1352	9	12	research	research	NOUN
ecletica-1352	9	13	group	group	NOUN
ecletica-1352	9	14	,	,	PUNCT
ecletica-1352	9	15	calabar	calabar	PROPN
ecletica-1352	9	16	,	,	PUNCT
ecletica-1352	9	17	nigeria	nigeria	PROPN
ecletica-1352	9	18	.	.	PUNCT
ecletica-1352	10	1	+	+	PUNCT
ecletica-1352	10	2	corresponding	correspond	VERB
ecletica-1352	10	3	author	author	NOUN
ecletica-1352	10	4	:	:	PUNCT
ecletica-1352	10	5	terkumbur	terkumbur	PROPN
ecletica-1352	10	6	emmanuel	emmanuel	PROPN
ecletica-1352	10	7	gber	gber	PROPN
ecletica-1352	10	8	,	,	PUNCT
ecletica-1352	10	9	phone	phone	NOUN
ecletica-1352	10	10	:	:	PUNCT
ecletica-1352	10	11	+2348059742439	+2348059742439	ADJ
ecletica-1352	10	12	,	,	PUNCT
ecletica-1352	10	13	email	email	NOUN
ecletica-1352	10	14	address	address	NOUN
ecletica-1352	10	15	:	:	PUNCT
ecletica-1352	10	16	gberterkumburemmanuel@gmail.com	gberterkumburemmanuel@gmail.com	X
ecletica-1352	10	17	article	article	NOUN
ecletica-1352	10	18	info	info	NOUN
ecletica-1352	10	19	article	article	NOUN
ecletica-1352	10	20	history	history	NOUN
ecletica-1352	10	21	:	:	PUNCT
ecletica-1352	10	22	received	receive	VERB
ecletica-1352	10	23	:	:	PUNCT
ecletica-1352	10	24	february	february	PROPN
ecletica-1352	10	25	27	27	NUM
ecletica-1352	10	26	,	,	PUNCT
ecletica-1352	10	27	2022	2022	NUM
ecletica-1352	10	28	accepted	accept	VERB
ecletica-1352	10	29	:	:	PUNCT
ecletica-1352	10	30	july	july	PROPN
ecletica-1352	10	31	11	11	NUM
ecletica-1352	10	32	,	,	PUNCT
ecletica-1352	10	33	2022	2022	NUM
ecletica-1352	10	34	published	publish	VERB
ecletica-1352	10	35	:	:	PUNCT
ecletica-1352	10	36	october	october	PROPN
ecletica-1352	10	37	28	28	NUM
ecletica-1352	10	38	,	,	PUNCT
ecletica-1352	10	39	2022	2022	NUM
ecletica-1352	10	40	keywords	keyword	NOUN
ecletica-1352	10	41	:	:	PUNCT
ecletica-1352	10	42	1	1	X
ecletica-1352	10	43	.	.	X
ecletica-1352	10	44	synthesis	synthesis	NOUN
ecletica-1352	10	45	2	2	NUM
ecletica-1352	10	46	.	.	PUNCT
ecletica-1352	10	47	characterizations	characterization	NOUN
ecletica-1352	10	48	3	3	NUM
ecletica-1352	10	49	.	.	PUNCT
ecletica-1352	10	50	antimicrobial	antimicrobial	ADJ
ecletica-1352	10	51	studies	study	NOUN
ecletica-1352	10	52	4	4	NUM
ecletica-1352	10	53	.	.	PUNCT
ecletica-1352	10	54	metal	metal	NOUN
ecletica-1352	10	55	-	-	PUNCT
ecletica-1352	10	56	organic	organic	ADJ
ecletica-1352	10	57	frameworks	framework	NOUN
ecletica-1352	10	58	section	section	NOUN
ecletica-1352	10	59	editors	editor	NOUN
ecletica-1352	10	60	:	:	PUNCT
ecletica-1352	10	61	assis	assis	PROPN
ecletica-1352	10	62	vicente	vicente	PROPN
ecletica-1352	10	63	benedetti	benedetti	PROPN
ecletica-1352	10	64	abstract	abstract	PROPN
ecletica-1352	10	65	:	:	PUNCT
ecletica-1352	10	66	the	the	DET
ecletica-1352	10	67	structure	structure	NOUN
ecletica-1352	10	68	of	of	ADP
ecletica-1352	10	69	the	the	DET
ecletica-1352	10	70	polymer	polymer	NOUN
ecletica-1352	10	71	[	[	X
ecletica-1352	10	72	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	10	73	was	be	AUX
ecletica-1352	10	74	identified	identify	VERB
ecletica-1352	10	75	by	by	ADP
ecletica-1352	10	76	x	x	NOUN
ecletica-1352	10	77	-	-	NOUN
ecletica-1352	10	78	ray	ray	ADJ
ecletica-1352	10	79	single	single	ADJ
ecletica-1352	10	80	-	-	PUNCT
ecletica-1352	10	81	crystal	crystal	NOUN
ecletica-1352	10	82	crystallography	crystallography	NOUN
ecletica-1352	10	83	.	.	PUNCT
ecletica-1352	11	1	the	the	DET
ecletica-1352	11	2	complex	complex	NOUN
ecletica-1352	11	3	’s	’s	PART
ecletica-1352	11	4	stability	stability	NOUN
ecletica-1352	11	5	and	and	CCONJ
ecletica-1352	11	6	overall	overall	ADJ
ecletica-1352	11	7	reactivity	reactivity	NOUN
ecletica-1352	11	8	were	be	AUX
ecletica-1352	11	9	examined	examine	VERB
ecletica-1352	11	10	at	at	ADP
ecletica-1352	11	11	the	the	DET
ecletica-1352	11	12	b3lyp/6	b3lyp/6	NOUN
ecletica-1352	11	13	-	-	X
ecletica-1352	11	14	311++g	311++g	NUM
ecletica-1352	11	15	(	(	PUNCT
ecletica-1352	11	16	d	d	PROPN
ecletica-1352	11	17	,	,	PUNCT
ecletica-1352	11	18	p	p	NOUN
ecletica-1352	11	19	)	)	PUNCT
ecletica-1352	11	20	level	level	NOUN
ecletica-1352	11	21	of	of	ADP
ecletica-1352	11	22	theory	theory	NOUN
ecletica-1352	11	23	whereas	whereas	SCONJ
ecletica-1352	11	24	the	the	DET
ecletica-1352	11	25	lighter	light	ADJ
ecletica-1352	11	26	elements	element	NOUN
ecletica-1352	11	27	(	(	PUNCT
ecletica-1352	11	28	h	h	NOUN
ecletica-1352	11	29	,	,	PUNCT
ecletica-1352	11	30	c	c	NOUN
ecletica-1352	11	31	,	,	PUNCT
ecletica-1352	11	32	and	and	CCONJ
ecletica-1352	11	33	o	o	X
ecletica-1352	11	34	)	)	PUNCT
ecletica-1352	11	35	were	be	AUX
ecletica-1352	11	36	studied	study	VERB
ecletica-1352	11	37	using	use	VERB
ecletica-1352	11	38	the	the	DET
ecletica-1352	11	39	lanl2dz	lanl2dz	ADJ
ecletica-1352	11	40	basis	basis	NOUN
ecletica-1352	11	41	set	set	NOUN
ecletica-1352	11	42	.	.	PUNCT
ecletica-1352	12	1	the	the	DET
ecletica-1352	12	2	electron	electron	NOUN
ecletica-1352	12	3	distribution	distribution	NOUN
ecletica-1352	12	4	in	in	ADP
ecletica-1352	12	5	the	the	DET
ecletica-1352	12	6	complex	complex	NOUN
ecletica-1352	12	7	’s	’s	PART
ecletica-1352	12	8	highest	high	ADJ
ecletica-1352	12	9	occupied	occupy	VERB
ecletica-1352	12	10	molecular	molecular	ADJ
ecletica-1352	12	11	orbital	orbital	NOUN
ecletica-1352	12	12	is	be	AUX
ecletica-1352	12	13	solely	solely	ADV
ecletica-1352	12	14	concentrated	concentrate	VERB
ecletica-1352	12	15	in	in	ADP
ecletica-1352	12	16	a	a	DET
ecletica-1352	12	17	small	small	ADJ
ecletica-1352	12	18	area	area	NOUN
ecletica-1352	12	19	,	,	PUNCT
ecletica-1352	12	20	with	with	ADP
ecletica-1352	12	21	no	no	DET
ecletica-1352	12	22	electrons	electron	NOUN
ecletica-1352	12	23	distributed	distribute	VERB
ecletica-1352	12	24	over	over	ADP
ecletica-1352	12	25	the	the	DET
ecletica-1352	12	26	cadmium	cadmium	NOUN
ecletica-1352	12	27	.	.	PUNCT
ecletica-1352	13	1	consequently	consequently	ADV
ecletica-1352	13	2	,	,	PUNCT
ecletica-1352	13	3	the	the	DET
ecletica-1352	13	4	electrons	electron	NOUN
ecletica-1352	13	5	in	in	ADP
ecletica-1352	13	6	the	the	DET
ecletica-1352	13	7	complex	complex	NOUN
ecletica-1352	13	8	’s	’s	PART
ecletica-1352	13	9	lowest	low	ADJ
ecletica-1352	13	10	unoccupied	unoccupied	ADJ
ecletica-1352	13	11	molecular	molecular	ADJ
ecletica-1352	13	12	orbital	orbital	ADJ
ecletica-1352	13	13	(	(	PUNCT
ecletica-1352	13	14	lumo	lumo	NOUN
ecletica-1352	13	15	)	)	PUNCT
ecletica-1352	13	16	were	be	AUX
ecletica-1352	13	17	dispersed	disperse	VERB
ecletica-1352	13	18	equally	equally	ADV
ecletica-1352	13	19	.	.	PUNCT
ecletica-1352	14	1	the	the	DET
ecletica-1352	14	2	cd	cd	PROPN
ecletica-1352	14	3	atom	atom	NOUN
ecletica-1352	14	4	is	be	AUX
ecletica-1352	14	5	partially	partially	ADV
ecletica-1352	14	6	obscured	obscure	VERB
ecletica-1352	14	7	by	by	ADP
ecletica-1352	14	8	charge	charge	NOUN
ecletica-1352	14	9	delocalization	delocalization	NOUN
ecletica-1352	14	10	in	in	ADP
ecletica-1352	14	11	the	the	DET
ecletica-1352	14	12	lumo	lumo	NOUN
ecletica-1352	14	13	.	.	PUNCT
ecletica-1352	15	1	the	the	DET
ecletica-1352	15	2	natural	natural	ADJ
ecletica-1352	15	3	bond	bond	NOUN
ecletica-1352	15	4	orbital	orbital	ADJ
ecletica-1352	15	5	analysis	analysis	NOUN
ecletica-1352	15	6	supports	support	VERB
ecletica-1352	15	7	the	the	DET
ecletica-1352	15	8	result	result	NOUN
ecletica-1352	15	9	for	for	ADP
ecletica-1352	15	10	reactivity	reactivity	NOUN
ecletica-1352	15	11	studies	study	NOUN
ecletica-1352	15	12	.	.	PUNCT
ecletica-1352	16	1	the	the	DET
ecletica-1352	16	2	rate	rate	NOUN
ecletica-1352	16	3	of	of	ADP
ecletica-1352	16	4	absorption	absorption	NOUN
ecletica-1352	16	5	,	,	PUNCT
ecletica-1352	16	6	distribution	distribution	NOUN
ecletica-1352	16	7	,	,	PUNCT
ecletica-1352	16	8	metabolism	metabolism	NOUN
ecletica-1352	16	9	,	,	PUNCT
ecletica-1352	16	10	excretion	excretion	NOUN
ecletica-1352	16	11	,	,	PUNCT
ecletica-1352	16	12	and	and	CCONJ
ecletica-1352	16	13	toxicity	toxicity	NOUN
ecletica-1352	16	14	(	(	PUNCT
ecletica-1352	16	15	admet	admet	PROPN
ecletica-1352	16	16	)	)	PUNCT
ecletica-1352	16	17	of	of	ADP
ecletica-1352	16	18	the	the	DET
ecletica-1352	16	19	complex	complex	NOUN
ecletica-1352	16	20	evaluated	evaluate	VERB
ecletica-1352	16	21	by	by	ADP
ecletica-1352	16	22	molecular	molecular	ADJ
ecletica-1352	16	23	docking	docking	NOUN
ecletica-1352	16	24	in	in	ADP
ecletica-1352	16	25	a	a	DET
ecletica-1352	16	26	bid	bid	NOUN
ecletica-1352	16	27	allowed	allow	VERB
ecletica-1352	16	28	comprehend	comprehend	VERB
ecletica-1352	16	29	the	the	DET
ecletica-1352	16	30	biological	biological	ADJ
ecletica-1352	16	31	applicability	applicability	NOUN
ecletica-1352	16	32	.	.	PUNCT
ecletica-1352	17	1	the	the	PRON
ecletica-1352	17	2	[	[	X
ecletica-1352	17	3	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	17	4	exhibited	exhibit	VERB
ecletica-1352	17	5	excellent	excellent	ADJ
ecletica-1352	17	6	binding	binding	ADJ
ecletica-1352	17	7	affinity	affinity	NOUN
ecletica-1352	17	8	with	with	ADP
ecletica-1352	17	9	proteins	protein	NOUN
ecletica-1352	17	10	1d7u	1d7u	NUM
ecletica-1352	17	11	and	and	CCONJ
ecletica-1352	17	12	2xcs	2xcs	NUM
ecletica-1352	17	13	,	,	PUNCT
ecletica-1352	17	14	while	while	SCONJ
ecletica-1352	17	15	by	by	ADP
ecletica-1352	17	16	admet	admet	PROPN
ecletica-1352	17	17	it	it	PRON
ecletica-1352	17	18	is	be	AUX
ecletica-1352	17	19	suggested	suggest	VERB
ecletica-1352	17	20	that	that	SCONJ
ecletica-1352	17	21	cytotoxicity	cytotoxicity	NOUN
ecletica-1352	17	22	and	and	CCONJ
ecletica-1352	17	23	carcinogenicity	carcinogenicity	NOUN
ecletica-1352	17	24	were	be	AUX
ecletica-1352	17	25	inactive	inactive	ADJ
ecletica-1352	17	26	.	.	PUNCT
ecletica-1352	18	1	it	it	PRON
ecletica-1352	18	2	is	be	AUX
ecletica-1352	18	3	clearly	clearly	ADV
ecletica-1352	18	4	shown	show	VERB
ecletica-1352	18	5	that	that	SCONJ
ecletica-1352	18	6	the	the	DET
ecletica-1352	18	7	complex	complex	NOUN
ecletica-1352	18	8	has	have	VERB
ecletica-1352	18	9	strong	strong	ADJ
ecletica-1352	18	10	biological	biological	ADJ
ecletica-1352	18	11	uses	use	NOUN
ecletica-1352	18	12	,	,	PUNCT
ecletica-1352	18	13	notably	notably	ADV
ecletica-1352	18	14	for	for	ADP
ecletica-1352	18	15	the	the	DET
ecletica-1352	18	16	treatment	treatment	NOUN
ecletica-1352	18	17	of	of	ADP
ecletica-1352	18	18	microbial	microbial	ADJ
ecletica-1352	18	19	diseases	disease	NOUN
ecletica-1352	18	20	.	.	PUNCT
ecletica-1352	19	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	19	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	19	3	mailto:gberterkumburemmanuel@gmail.com	mailto:gberterkumburemmanuel@gmail.com	PROPN
ecletica-1352	19	4	https://orcid.org/0000-0002-5274-4824	https://orcid.org/0000-0002-5274-4824	PROPN
ecletica-1352	19	5	https://orcid.org/0000-0002-1901-3675	https://orcid.org/0000-0002-1901-3675	VERB
ecletica-1352	19	6	https://orcid.org/0000-0002-8981-7759	https://orcid.org/0000-0002-8981-7759	PROPN
ecletica-1352	19	7	https://orcid.org/0000-0002-3642-7298	https://orcid.org/0000-0002-3642-7298	PROPN
ecletica-1352	19	8	https://orcid.org/0000-0001-9007-4596	https://orcid.org/0000-0001-9007-4596	PROPN
ecletica-1352	19	9	https://orcid.org/0000-0003-0821-6861	https://orcid.org/0000-0003-0821-6861	PROPN
ecletica-1352	19	10	original	original	ADJ
ecletica-1352	19	11	article	article	NOUN
ecletica-1352	19	12	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	19	13	38	38	NUM
ecletica-1352	19	14	eclética	eclética	PROPN
ecletica-1352	19	15	química	química	PROPN
ecletica-1352	19	16	journal	journal	PROPN
ecletica-1352	19	17	,	,	PUNCT
ecletica-1352	19	18	vol	vol	NOUN
ecletica-1352	19	19	.	.	PROPN
ecletica-1352	20	1	47	47	NUM
ecletica-1352	20	2	,	,	PUNCT
ecletica-1352	20	3	n.	n.	NOUN
ecletica-1352	20	4	4	4	NUM
ecletica-1352	20	5	,	,	PUNCT
ecletica-1352	20	6	2022	2022	NUM
ecletica-1352	20	7	,	,	PUNCT
ecletica-1352	20	8	37	37	NUM
ecletica-1352	20	9	-	-	SYM
ecletica-1352	20	10	50	50	NUM
ecletica-1352	20	11	issn	issn	NOUN
ecletica-1352	20	12	:	:	PUNCT
ecletica-1352	20	13	1678	1678	NUM
ecletica-1352	20	14	-	-	SYM
ecletica-1352	20	15	4618	4618	NUM
ecletica-1352	20	16	doi	doi	NOUN
ecletica-1352	20	17	:	:	PUNCT
ecletica-1352	20	18	10.26850/1678	10.26850/1678	NUM
ecletica-1352	20	19	-	-	PUNCT
ecletica-1352	20	20	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	20	21	-	-	ADJ
ecletica-1352	20	22	50	50	NUM
ecletica-1352	20	23	1	1	NUM
ecletica-1352	20	24	.	.	PUNCT
ecletica-1352	21	1	introduction	introduction	NOUN
ecletica-1352	21	2	microbes	microbe	NOUN
ecletica-1352	21	3	are	be	AUX
ecletica-1352	21	4	living	live	VERB
ecletica-1352	21	5	creatures	creature	NOUN
ecletica-1352	21	6	such	such	ADJ
ecletica-1352	21	7	as	as	ADP
ecletica-1352	21	8	bacteria	bacteria	NOUN
ecletica-1352	21	9	,	,	PUNCT
ecletica-1352	21	10	fungus	fungus	NOUN
ecletica-1352	21	11	,	,	PUNCT
ecletica-1352	21	12	viruses	virus	NOUN
ecletica-1352	21	13	,	,	PUNCT
ecletica-1352	21	14	and	and	CCONJ
ecletica-1352	21	15	parasites	parasite	NOUN
ecletica-1352	21	16	that	that	PRON
ecletica-1352	21	17	evolve	evolve	VERB
ecletica-1352	21	18	through	through	ADP
ecletica-1352	21	19	time	time	NOUN
ecletica-1352	21	20	.	.	PUNCT
ecletica-1352	22	1	their	their	PRON
ecletica-1352	22	2	primary	primary	ADJ
ecletica-1352	22	3	goals	goal	NOUN
ecletica-1352	22	4	are	be	AUX
ecletica-1352	22	5	to	to	PART
ecletica-1352	22	6	survive	survive	VERB
ecletica-1352	22	7	,	,	PUNCT
ecletica-1352	22	8	reproduce	reproduce	VERB
ecletica-1352	22	9	and	and	CCONJ
ecletica-1352	22	10	spread	spread	VERB
ecletica-1352	22	11	.	.	PUNCT
ecletica-1352	23	1	they	they	PRON
ecletica-1352	23	2	modify	modify	VERB
ecletica-1352	23	3	and	and	CCONJ
ecletica-1352	23	4	adapt	adapt	VERB
ecletica-1352	23	5	to	to	ADP
ecletica-1352	23	6	their	their	PRON
ecletica-1352	23	7	surroundings	surrounding	NOUN
ecletica-1352	23	8	in	in	ADP
ecletica-1352	23	9	order	order	NOUN
ecletica-1352	23	10	to	to	PART
ecletica-1352	23	11	survive	survive	VERB
ecletica-1352	23	12	(	(	PUNCT
ecletica-1352	23	13	gupta	gupta	PROPN
ecletica-1352	23	14	et	et	PROPN
ecletica-1352	23	15	al	al	PROPN
ecletica-1352	23	16	.	.	PROPN
ecletica-1352	23	17	,	,	PUNCT
ecletica-1352	23	18	2017	2017	NUM
ecletica-1352	23	19	;	;	PUNCT
ecletica-1352	23	20	reygaert	reygaert	NOUN
ecletica-1352	23	21	,	,	PUNCT
ecletica-1352	23	22	2018	2018	NUM
ecletica-1352	23	23	)	)	PUNCT
ecletica-1352	23	24	.	.	PUNCT
ecletica-1352	24	1	genetic	genetic	ADJ
ecletica-1352	24	2	alterations	alteration	NOUN
ecletica-1352	24	3	may	may	AUX
ecletica-1352	24	4	take	take	VERB
ecletica-1352	24	5	place	place	NOUN
ecletica-1352	24	6	in	in	ADP
ecletica-1352	24	7	the	the	DET
ecletica-1352	24	8	presence	presence	NOUN
ecletica-1352	24	9	of	of	ADP
ecletica-1352	24	10	an	an	DET
ecletica-1352	24	11	antimicrobial	antimicrobial	ADJ
ecletica-1352	24	12	inhibitor	inhibitor	NOUN
ecletica-1352	24	13	to	to	PART
ecletica-1352	24	14	guarantee	guarantee	VERB
ecletica-1352	24	15	the	the	DET
ecletica-1352	24	16	bacteria	bacteria	NOUN
ecletica-1352	24	17	’s	’s	PART
ecletica-1352	24	18	ongoing	ongoing	ADJ
ecletica-1352	24	19	existence	existence	NOUN
ecletica-1352	24	20	(	(	PUNCT
ecletica-1352	24	21	purssell	purssell	PROPN
ecletica-1352	24	22	,	,	PUNCT
ecletica-1352	24	23	2020	2020	NUM
ecletica-1352	24	24	)	)	PUNCT
ecletica-1352	24	25	.	.	PUNCT
ecletica-1352	25	1	the	the	DET
ecletica-1352	25	2	mortality	mortality	NOUN
ecletica-1352	25	3	rate	rate	NOUN
ecletica-1352	25	4	from	from	ADP
ecletica-1352	25	5	infectious	infectious	ADJ
ecletica-1352	25	6	diseases	disease	NOUN
ecletica-1352	25	7	brought	bring	VERB
ecletica-1352	25	8	on	on	ADP
ecletica-1352	25	9	by	by	ADP
ecletica-1352	25	10	resistant	resistant	ADJ
ecletica-1352	25	11	bacteria	bacteria	NOUN
ecletica-1352	25	12	has	have	AUX
ecletica-1352	25	13	increased	increase	VERB
ecletica-1352	25	14	as	as	ADP
ecletica-1352	25	15	a	a	DET
ecletica-1352	25	16	result	result	NOUN
ecletica-1352	25	17	of	of	ADP
ecletica-1352	25	18	antimicrobial	antimicrobial	ADJ
ecletica-1352	25	19	drug	drug	NOUN
ecletica-1352	25	20	resistance	resistance	NOUN
ecletica-1352	25	21	to	to	ADP
ecletica-1352	25	22	certain	certain	ADJ
ecletica-1352	25	23	antibiotics	antibiotic	NOUN
ecletica-1352	25	24	,	,	PUNCT
ecletica-1352	25	25	such	such	ADJ
ecletica-1352	25	26	as	as	ADP
ecletica-1352	25	27	quinolones	quinolone	NOUN
ecletica-1352	25	28	(	(	PUNCT
ecletica-1352	25	29	balaban	balaban	NOUN
ecletica-1352	25	30	et	et	PROPN
ecletica-1352	25	31	al	al	PROPN
ecletica-1352	25	32	.	.	PROPN
ecletica-1352	25	33	,	,	PUNCT
ecletica-1352	25	34	2019	2019	NUM
ecletica-1352	25	35	;	;	PUNCT
ecletica-1352	25	36	odonkor	odonkor	PROPN
ecletica-1352	25	37	and	and	CCONJ
ecletica-1352	25	38	addo	addo	NOUN
ecletica-1352	25	39	,	,	PUNCT
ecletica-1352	25	40	2011	2011	NUM
ecletica-1352	25	41	)	)	PUNCT
ecletica-1352	25	42	.	.	PUNCT
ecletica-1352	26	1	therefore	therefore	ADV
ecletica-1352	26	2	,	,	PUNCT
ecletica-1352	26	3	it	it	PRON
ecletica-1352	26	4	is	be	AUX
ecletica-1352	26	5	necessary	necessary	ADJ
ecletica-1352	26	6	to	to	PART
ecletica-1352	26	7	create	create	VERB
ecletica-1352	26	8	efficient	efficient	ADJ
ecletica-1352	26	9	microbial	microbial	ADJ
ecletica-1352	26	10	agents	agent	NOUN
ecletica-1352	26	11	that	that	PRON
ecletica-1352	26	12	are	be	AUX
ecletica-1352	26	13	aimed	aim	VERB
ecletica-1352	26	14	at	at	ADP
ecletica-1352	26	15	these	these	DET
ecletica-1352	26	16	issues	issue	NOUN
ecletica-1352	26	17	.	.	PUNCT
ecletica-1352	27	1	due	due	ADP
ecletica-1352	27	2	to	to	ADP
ecletica-1352	27	3	their	their	PRON
ecletica-1352	27	4	highly	highly	ADV
ecletica-1352	27	5	porous	porous	ADJ
ecletica-1352	27	6	nature	nature	NOUN
ecletica-1352	27	7	and	and	CCONJ
ecletica-1352	27	8	adaptable	adaptable	ADJ
ecletica-1352	27	9	hybrid	hybrid	ADJ
ecletica-1352	27	10	composition	composition	NOUN
ecletica-1352	27	11	,	,	PUNCT
ecletica-1352	27	12	metal	metal	NOUN
ecletica-1352	27	13	organic	organic	ADJ
ecletica-1352	27	14	frameworks	framework	NOUN
ecletica-1352	27	15	(	(	PUNCT
ecletica-1352	27	16	mofs	mof	NOUN
ecletica-1352	27	17	)	)	PUNCT
ecletica-1352	27	18	,	,	PUNCT
ecletica-1352	27	19	which	which	PRON
ecletica-1352	27	20	are	be	AUX
ecletica-1352	27	21	porous	porous	ADJ
ecletica-1352	27	22	coordination	coordination	NOUN
ecletica-1352	27	23	polymers	polymer	NOUN
ecletica-1352	27	24	,	,	PUNCT
ecletica-1352	27	25	made	make	VERB
ecletica-1352	27	26	of	of	ADP
ecletica-1352	27	27	metal	metal	NOUN
ecletica-1352	27	28	ions	ion	NOUN
ecletica-1352	27	29	and	and	CCONJ
ecletica-1352	27	30	organic	organic	ADJ
ecletica-1352	27	31	ligands	ligand	NOUN
ecletica-1352	27	32	,	,	PUNCT
ecletica-1352	27	33	have	have	AUX
ecletica-1352	27	34	become	become	VERB
ecletica-1352	27	35	new	new	ADJ
ecletica-1352	27	36	contenders	contender	NOUN
ecletica-1352	27	37	in	in	ADP
ecletica-1352	27	38	the	the	DET
ecletica-1352	27	39	search	search	NOUN
ecletica-1352	27	40	for	for	ADP
ecletica-1352	27	41	novel	novel	ADJ
ecletica-1352	27	42	dosage	dosage	NOUN
ecletica-1352	27	43	forms	form	NOUN
ecletica-1352	27	44	that	that	PRON
ecletica-1352	27	45	may	may	AUX
ecletica-1352	27	46	be	be	AUX
ecletica-1352	27	47	used	use	VERB
ecletica-1352	27	48	to	to	PART
ecletica-1352	27	49	enhance	enhance	VERB
ecletica-1352	27	50	a	a	DET
ecletica-1352	27	51	patient	patient	NOUN
ecletica-1352	27	52	’s	’s	PART
ecletica-1352	27	53	treatment	treatment	NOUN
ecletica-1352	27	54	and	and	CCONJ
ecletica-1352	27	55	quality	quality	NOUN
ecletica-1352	27	56	of	of	ADP
ecletica-1352	27	57	life	life	NOUN
ecletica-1352	27	58	in	in	ADP
ecletica-1352	27	59	general	general	ADJ
ecletica-1352	27	60	.	.	PUNCT
ecletica-1352	28	1	because	because	SCONJ
ecletica-1352	28	2	of	of	ADP
ecletica-1352	28	3	their	their	PRON
ecletica-1352	28	4	superior	superior	ADJ
ecletica-1352	28	5	encapsulation	encapsulation	NOUN
ecletica-1352	28	6	and	and	CCONJ
ecletica-1352	28	7	physiochemical	physiochemical	ADJ
ecletica-1352	28	8	(	(	PUNCT
ecletica-1352	28	9	releasing	releasing	NOUN
ecletica-1352	28	10	)	)	PUNCT
ecletica-1352	28	11	capabilities	capability	NOUN
ecletica-1352	28	12	,	,	PUNCT
ecletica-1352	28	13	these	these	DET
ecletica-1352	28	14	solids	solid	NOUN
ecletica-1352	28	15	,	,	PUNCT
ecletica-1352	28	16	which	which	PRON
ecletica-1352	28	17	were	be	AUX
ecletica-1352	28	18	originally	originally	ADV
ecletica-1352	28	19	thought	think	VERB
ecletica-1352	28	20	to	to	PART
ecletica-1352	28	21	be	be	AUX
ecletica-1352	28	22	best	well	ADV
ecletica-1352	28	23	suited	suit	VERB
ecletica-1352	28	24	for	for	ADP
ecletica-1352	28	25	other	other	ADJ
ecletica-1352	28	26	uses	use	NOUN
ecletica-1352	28	27	including	include	VERB
ecletica-1352	28	28	sensing	sense	VERB
ecletica-1352	28	29	(	(	PUNCT
ecletica-1352	28	30	sun	sun	PROPN
ecletica-1352	28	31	et	et	PROPN
ecletica-1352	28	32	al	al	PROPN
ecletica-1352	28	33	.	.	PROPN
ecletica-1352	28	34	,	,	PUNCT
ecletica-1352	28	35	2013	2013	NUM
ecletica-1352	28	36	;	;	PUNCT
ecletica-1352	28	37	vikrant	vikrant	PROPN
ecletica-1352	28	38	et	et	PROPN
ecletica-1352	28	39	al	al	PROPN
ecletica-1352	28	40	.	.	PROPN
ecletica-1352	28	41	,	,	PUNCT
ecletica-1352	28	42	2018	2018	NUM
ecletica-1352	28	43	)	)	PUNCT
ecletica-1352	28	44	,	,	PUNCT
ecletica-1352	28	45	catalysis	catalysis	NOUN
ecletica-1352	28	46	(	(	PUNCT
ecletica-1352	28	47	li	li	PROPN
ecletica-1352	28	48	et	et	PROPN
ecletica-1352	28	49	al	al	PROPN
ecletica-1352	28	50	.	.	PROPN
ecletica-1352	28	51	,	,	PUNCT
ecletica-1352	28	52	2019	2019	NUM
ecletica-1352	28	53	)	)	PUNCT
ecletica-1352	28	54	,	,	PUNCT
ecletica-1352	28	55	gas	gas	NOUN
ecletica-1352	28	56	storage	storage	NOUN
ecletica-1352	28	57	(	(	PUNCT
ecletica-1352	28	58	cai	cai	X
ecletica-1352	28	59	et	et	PROPN
ecletica-1352	28	60	al	al	PROPN
ecletica-1352	28	61	.	.	PROPN
ecletica-1352	28	62	,	,	PUNCT
ecletica-1352	28	63	2020	2020	NUM
ecletica-1352	28	64	)	)	PUNCT
ecletica-1352	28	65	,	,	PUNCT
ecletica-1352	28	66	and	and	CCONJ
ecletica-1352	28	67	separation	separation	NOUN
ecletica-1352	28	68	,	,	PUNCT
ecletica-1352	28	69	have	have	AUX
ecletica-1352	28	70	now	now	ADV
ecletica-1352	28	71	been	be	AUX
ecletica-1352	28	72	used	use	VERB
ecletica-1352	28	73	in	in	ADP
ecletica-1352	28	74	biological	biological	ADJ
ecletica-1352	28	75	applications	application	NOUN
ecletica-1352	28	76	.	.	PUNCT
ecletica-1352	29	1	a	a	DET
ecletica-1352	29	2	wide	wide	ADJ
ecletica-1352	29	3	range	range	NOUN
ecletica-1352	29	4	of	of	ADP
ecletica-1352	29	5	applications	application	NOUN
ecletica-1352	29	6	for	for	ADP
ecletica-1352	29	7	mofs	mof	NOUN
ecletica-1352	29	8	in	in	ADP
ecletica-1352	29	9	medication	medication	NOUN
ecletica-1352	29	10	delivery	delivery	NOUN
ecletica-1352	29	11	are	be	AUX
ecletica-1352	29	12	being	be	AUX
ecletica-1352	29	13	investigated	investigate	VERB
ecletica-1352	29	14	.	.	PUNCT
ecletica-1352	30	1	these	these	DET
ecletica-1352	30	2	solids	solid	NOUN
ecletica-1352	30	3	,	,	PUNCT
ecletica-1352	30	4	which	which	PRON
ecletica-1352	30	5	were	be	AUX
ecletica-1352	30	6	first	first	ADV
ecletica-1352	30	7	employed	employ	VERB
ecletica-1352	30	8	to	to	PART
ecletica-1352	30	9	transport	transport	VERB
ecletica-1352	30	10	medications	medication	NOUN
ecletica-1352	30	11	in	in	ADP
ecletica-1352	30	12	the	the	DET
ecletica-1352	30	13	form	form	NOUN
ecletica-1352	30	14	of	of	ADP
ecletica-1352	30	15	tiny	tiny	ADJ
ecletica-1352	30	16	molecules	molecule	NOUN
ecletica-1352	30	17	,	,	PUNCT
ecletica-1352	30	18	are	be	AUX
ecletica-1352	30	19	currently	currently	ADV
ecletica-1352	30	20	a	a	DET
ecletica-1352	30	21	subject	subject	NOUN
ecletica-1352	30	22	of	of	ADP
ecletica-1352	30	23	increased	increase	VERB
ecletica-1352	30	24	research	research	NOUN
ecletica-1352	30	25	for	for	ADP
ecletica-1352	30	26	the	the	DET
ecletica-1352	30	27	delivery	delivery	NOUN
ecletica-1352	30	28	of	of	ADP
ecletica-1352	30	29	treatments	treatment	NOUN
ecletica-1352	30	30	of	of	ADP
ecletica-1352	30	31	all	all	DET
ecletica-1352	30	32	types	type	NOUN
ecletica-1352	30	33	,	,	PUNCT
ecletica-1352	30	34	including	include	VERB
ecletica-1352	30	35	macromolecular	macromolecular	ADJ
ecletica-1352	30	36	cargos	cargo	NOUN
ecletica-1352	30	37	such	such	ADJ
ecletica-1352	30	38	proteins	protein	NOUN
ecletica-1352	30	39	(	(	PUNCT
ecletica-1352	30	40	chuhadiya	chuhadiya	NOUN
ecletica-1352	30	41	et	et	NOUN
ecletica-1352	30	42	al	al	PROPN
ecletica-1352	30	43	.	.	PROPN
ecletica-1352	30	44	,	,	PUNCT
ecletica-1352	30	45	2021	2021	NUM
ecletica-1352	30	46	;	;	PUNCT
ecletica-1352	30	47	lawson	lawson	PROPN
ecletica-1352	30	48	et	et	PROPN
ecletica-1352	30	49	al	al	PROPN
ecletica-1352	30	50	.	.	PROPN
ecletica-1352	30	51	,	,	PUNCT
ecletica-1352	30	52	2021	2021	NUM
ecletica-1352	30	53	;	;	PUNCT
ecletica-1352	30	54	pastore	pastore	NOUN
ecletica-1352	30	55	et	et	PROPN
ecletica-1352	30	56	al	al	PROPN
ecletica-1352	30	57	.	.	PROPN
ecletica-1352	30	58	,	,	PUNCT
ecletica-1352	30	59	2018	2018	NUM
ecletica-1352	30	60	)	)	PUNCT
ecletica-1352	30	61	,	,	PUNCT
ecletica-1352	30	62	nucleic	nucleic	ADJ
ecletica-1352	30	63	acids	acid	NOUN
ecletica-1352	30	64	,	,	PUNCT
ecletica-1352	30	65	cells	cell	NOUN
ecletica-1352	30	66	(	(	PUNCT
ecletica-1352	30	67	kumar	kumar	PROPN
ecletica-1352	30	68	et	et	PROPN
ecletica-1352	30	69	al	al	PROPN
ecletica-1352	30	70	.	.	PROPN
ecletica-1352	30	71	,	,	PUNCT
ecletica-1352	30	72	2015	2015	NUM
ecletica-1352	30	73	)	)	PUNCT
ecletica-1352	30	74	.	.	PUNCT
ecletica-1352	31	1	to	to	PART
ecletica-1352	31	2	sufficiently	sufficiently	ADV
ecletica-1352	31	3	explain	explain	VERB
ecletica-1352	31	4	how	how	SCONJ
ecletica-1352	31	5	cadmium	cadmium	NOUN
ecletica-1352	31	6	is	be	AUX
ecletica-1352	31	7	employed	employ	VERB
ecletica-1352	31	8	in	in	ADP
ecletica-1352	31	9	biological	biological	ADJ
ecletica-1352	31	10	applications	application	NOUN
ecletica-1352	31	11	.	.	PUNCT
ecletica-1352	32	1	here	here	ADV
ecletica-1352	32	2	,	,	PUNCT
ecletica-1352	32	3	we	we	PRON
ecletica-1352	32	4	report	report	VERB
ecletica-1352	32	5	recent	recent	ADJ
ecletica-1352	32	6	articles	article	NOUN
ecletica-1352	32	7	that	that	PRON
ecletica-1352	32	8	expressly	expressly	ADV
ecletica-1352	32	9	assert	assert	VERB
ecletica-1352	32	10	that	that	SCONJ
ecletica-1352	32	11	cadmium	cadmium	NOUN
ecletica-1352	32	12	exhibits	exhibit	VERB
ecletica-1352	32	13	substantial	substantial	ADJ
ecletica-1352	32	14	biological	biological	ADJ
ecletica-1352	32	15	activity	activity	NOUN
ecletica-1352	32	16	.	.	PUNCT
ecletica-1352	33	1	in	in	ADP
ecletica-1352	33	2	this	this	DET
ecletica-1352	33	3	context	context	NOUN
ecletica-1352	33	4	,	,	PUNCT
ecletica-1352	33	5	density	density	NOUN
ecletica-1352	33	6	functional	functional	ADJ
ecletica-1352	33	7	theory	theory	NOUN
ecletica-1352	33	8	(	(	PUNCT
ecletica-1352	33	9	dft	dft	NOUN
ecletica-1352	33	10	)	)	PUNCT
ecletica-1352	33	11	has	have	AUX
ecletica-1352	33	12	recently	recently	ADV
ecletica-1352	33	13	been	be	AUX
ecletica-1352	33	14	applied	apply	VERB
ecletica-1352	33	15	to	to	PART
ecletica-1352	33	16	theoretically	theoretically	ADV
ecletica-1352	33	17	examine	examine	VERB
ecletica-1352	33	18	the	the	DET
ecletica-1352	33	19	bioactivity	bioactivity	NOUN
ecletica-1352	33	20	of	of	ADP
ecletica-1352	33	21	cadmium	cadmium	NOUN
ecletica-1352	33	22	complexes	complex	NOUN
ecletica-1352	33	23	as	as	ADP
ecletica-1352	33	24	promising	promise	VERB
ecletica-1352	33	25	antibacterial	antibacterial	ADJ
ecletica-1352	33	26	therapeutics	therapeutic	NOUN
ecletica-1352	33	27	.	.	PUNCT
ecletica-1352	34	1	dft	dft	PROPN
ecletica-1352	34	2	studies	study	NOUN
ecletica-1352	34	3	,	,	PUNCT
ecletica-1352	34	4	hirschfeld	hirschfeld	PROPN
ecletica-1352	34	5	surface	surface	PROPN
ecletica-1352	34	6	analysis	analysis	NOUN
ecletica-1352	34	7	and	and	CCONJ
ecletica-1352	34	8	antimicrobial	antimicrobial	ADJ
ecletica-1352	34	9	activity	activity	NOUN
ecletica-1352	34	10	were	be	AUX
ecletica-1352	34	11	reported	report	VERB
ecletica-1352	34	12	to	to	PART
ecletica-1352	34	13	be	be	AUX
ecletica-1352	34	14	effective	effective	ADJ
ecletica-1352	34	15	in	in	ADP
ecletica-1352	34	16	biological	biological	ADJ
ecletica-1352	34	17	application	application	NOUN
ecletica-1352	34	18	most	most	ADV
ecletica-1352	34	19	significantly	significantly	ADV
ecletica-1352	34	20	in	in	ADP
ecletica-1352	34	21	the	the	DET
ecletica-1352	34	22	treatment	treatment	NOUN
ecletica-1352	34	23	of	of	ADP
ecletica-1352	34	24	microbial	microbial	ADJ
ecletica-1352	34	25	diseases	disease	NOUN
ecletica-1352	34	26	as	as	SCONJ
ecletica-1352	34	27	reported	report	VERB
ecletica-1352	34	28	by	by	ADP
ecletica-1352	34	29	el	el	PROPN
ecletica-1352	34	30	-	-	PUNCT
ecletica-1352	34	31	gammal	gammal	PROPN
ecletica-1352	34	32	et	et	PROPN
ecletica-1352	34	33	al	al	PROPN
ecletica-1352	34	34	.	.	PROPN
ecletica-1352	35	1	(	(	PUNCT
ecletica-1352	35	2	2014	2014	NUM
ecletica-1352	35	3	)	)	PUNCT
ecletica-1352	35	4	.	.	PUNCT
ecletica-1352	36	1	additionally	additionally	ADV
ecletica-1352	36	2	,	,	PUNCT
ecletica-1352	36	3	hamdani	hamdani	ADJ
ecletica-1352	36	4	and	and	CCONJ
ecletica-1352	36	5	amane	amane	NOUN
ecletica-1352	36	6	(	(	PUNCT
ecletica-1352	36	7	2019	2019	NUM
ecletica-1352	36	8	)	)	PUNCT
ecletica-1352	36	9	carried	carry	VERB
ecletica-1352	36	10	out	out	ADP
ecletica-1352	36	11	preparation	preparation	NOUN
ecletica-1352	36	12	,	,	PUNCT
ecletica-1352	36	13	spectral	spectral	ADJ
ecletica-1352	36	14	,	,	PUNCT
ecletica-1352	36	15	antibacterial	antibacterial	ADJ
ecletica-1352	36	16	,	,	PUNCT
ecletica-1352	36	17	and	and	CCONJ
ecletica-1352	36	18	anticancer	anticancer	NOUN
ecletica-1352	36	19	molecular	molecular	ADJ
ecletica-1352	36	20	docking	docking	NOUN
ecletica-1352	36	21	investigations	investigation	NOUN
ecletica-1352	36	22	of	of	ADP
ecletica-1352	36	23	novel	novel	ADJ
ecletica-1352	36	24	metal	metal	NOUN
ecletica-1352	36	25	complexes	complex	NOUN
ecletica-1352	36	26	[	[	X
ecletica-1352	36	27	m(caffeine)4	m(caffeine)4	X
ecletica-1352	36	28	]	]	X
ecletica-1352	36	29	(	(	PUNCT
ecletica-1352	36	30	pf6)2	pf6)2	PROPN
ecletica-1352	36	31	,	,	PUNCT
ecletica-1352	36	32	where	where	SCONJ
ecletica-1352	36	33	m	m	PROPN
ecletica-1352	36	34	was	be	AUX
ecletica-1352	36	35	the	the	DET
ecletica-1352	36	36	chosen	choose	VERB
ecletica-1352	36	37	metal	metal	NOUN
ecletica-1352	36	38	including	include	VERB
ecletica-1352	36	39	cadmium	cadmium	NOUN
ecletica-1352	36	40	.	.	PUNCT
ecletica-1352	37	1	this	this	DET
ecletica-1352	37	2	finding	finding	NOUN
ecletica-1352	37	3	demonstrated	demonstrate	VERB
ecletica-1352	37	4	the	the	DET
ecletica-1352	37	5	cadmium	cadmium	NOUN
ecletica-1352	37	6	complex	complex	NOUN
ecletica-1352	37	7	’s	’s	PART
ecletica-1352	37	8	high	high	ADJ
ecletica-1352	37	9	calculated	calculate	VERB
ecletica-1352	37	10	affinity	affinity	NOUN
ecletica-1352	37	11	for	for	ADP
ecletica-1352	37	12	the	the	DET
ecletica-1352	37	13	protein	protein	NOUN
ecletica-1352	37	14	p13k	p13k	NOUN
ecletica-1352	37	15	,	,	PUNCT
ecletica-1352	37	16	demonstrating	demonstrate	VERB
ecletica-1352	37	17	the	the	DET
ecletica-1352	37	18	complex	complex	NOUN
ecletica-1352	37	19	’s	’s	PART
ecletica-1352	37	20	potential	potential	NOUN
ecletica-1352	37	21	as	as	ADP
ecletica-1352	37	22	a	a	DET
ecletica-1352	37	23	therapeutic	therapeutic	ADJ
ecletica-1352	37	24	candidate	candidate	NOUN
ecletica-1352	37	25	to	to	PART
ecletica-1352	37	26	treat	treat	VERB
ecletica-1352	37	27	microbial	microbial	ADJ
ecletica-1352	37	28	infections	infection	NOUN
ecletica-1352	37	29	.	.	PUNCT
ecletica-1352	38	1	on	on	ADP
ecletica-1352	38	2	the	the	DET
ecletica-1352	38	3	other	other	ADJ
ecletica-1352	38	4	hand	hand	NOUN
ecletica-1352	38	5	,	,	PUNCT
ecletica-1352	38	6	el	el	NOUN
ecletica-1352	38	7	-	-	PUNCT
ecletica-1352	38	8	gammal	gammal	PROPN
ecletica-1352	38	9	et	et	PROPN
ecletica-1352	38	10	al	al	PROPN
ecletica-1352	38	11	.	.	PROPN
ecletica-1352	39	1	(	(	PUNCT
ecletica-1352	39	2	2014	2014	NUM
ecletica-1352	39	3	)	)	PUNCT
ecletica-1352	39	4	conducted	conduct	VERB
ecletica-1352	39	5	research	research	NOUN
ecletica-1352	39	6	on	on	ADP
ecletica-1352	39	7	the	the	DET
ecletica-1352	39	8	synthesis	synthesis	NOUN
ecletica-1352	39	9	,	,	PUNCT
ecletica-1352	39	10	characterization	characterization	NOUN
ecletica-1352	39	11	,	,	PUNCT
ecletica-1352	39	12	dft	dft	PROPN
ecletica-1352	39	13	,	,	PUNCT
ecletica-1352	39	14	and	and	CCONJ
ecletica-1352	39	15	biological	biological	ADJ
ecletica-1352	39	16	investigations	investigation	NOUN
ecletica-1352	39	17	of	of	ADP
ecletica-1352	39	18	isatinpicolinohydrazone	isatinpicolinohydrazone	NOUN
ecletica-1352	39	19	interacted	interact	VERB
ecletica-1352	39	20	with	with	ADP
ecletica-1352	39	21	zn(ii	zn(ii	NOUN
ecletica-1352	39	22	)	)	PUNCT
ecletica-1352	39	23	,	,	PUNCT
ecletica-1352	39	24	cd(ii	cd(ii	PROPN
ecletica-1352	39	25	)	)	PUNCT
ecletica-1352	39	26	,	,	PUNCT
ecletica-1352	39	27	and	and	CCONJ
ecletica-1352	39	28	hg(ii	hg(ii	PROPN
ecletica-1352	39	29	)	)	PUNCT
ecletica-1352	39	30	,	,	PUNCT
ecletica-1352	39	31	reporting	report	VERB
ecletica-1352	39	32	that	that	SCONJ
ecletica-1352	39	33	these	these	DET
ecletica-1352	39	34	metals	metal	NOUN
ecletica-1352	39	35	demonstrated	demonstrate	VERB
ecletica-1352	39	36	robust	robust	ADJ
ecletica-1352	39	37	action	action	NOUN
ecletica-1352	39	38	in	in	ADP
ecletica-1352	39	39	biological	biological	ADJ
ecletica-1352	39	40	studies	study	NOUN
ecletica-1352	39	41	involving	involve	VERB
ecletica-1352	39	42	cd(ii	cd(ii	NOUN
ecletica-1352	39	43	)	)	PUNCT
ecletica-1352	39	44	.	.	PUNCT
ecletica-1352	40	1	in	in	ADP
ecletica-1352	40	2	a	a	DET
ecletica-1352	40	3	similar	similar	ADJ
ecletica-1352	40	4	vein	vein	NOUN
ecletica-1352	40	5	,	,	PUNCT
ecletica-1352	40	6	konakanchi	konakanchi	PROPN
ecletica-1352	40	7	et	et	PROPN
ecletica-1352	40	8	al	al	PROPN
ecletica-1352	40	9	.	.	PROPN
ecletica-1352	41	1	(	(	PUNCT
ecletica-1352	41	2	2018	2018	NUM
ecletica-1352	41	3	)	)	PUNCT
ecletica-1352	41	4	investigated	investigate	VERB
ecletica-1352	41	5	the	the	DET
ecletica-1352	41	6	synthesis	synthesis	NOUN
ecletica-1352	41	7	,	,	PUNCT
ecletica-1352	41	8	structural	structural	ADJ
ecletica-1352	41	9	,	,	PUNCT
ecletica-1352	41	10	biological	biological	ADJ
ecletica-1352	41	11	evaluation	evaluation	NOUN
ecletica-1352	41	12	,	,	PUNCT
ecletica-1352	41	13	molecular	molecular	ADJ
ecletica-1352	41	14	docking	docking	NOUN
ecletica-1352	41	15	,	,	PUNCT
ecletica-1352	41	16	and	and	CCONJ
ecletica-1352	41	17	dft	dft	NOUN
ecletica-1352	41	18	properties	property	NOUN
ecletica-1352	41	19	of	of	ADP
ecletica-1352	41	20	complexes	complex	NOUN
ecletica-1352	41	21	containing	contain	VERB
ecletica-1352	41	22	heterocyclic	heterocyclic	ADJ
ecletica-1352	41	23	thiosemicarbazones	thiosemicarbazone	NOUN
ecletica-1352	41	24	in	in	ADP
ecletica-1352	41	25	co(ii	co(ii	PROPN
ecletica-1352	41	26	)	)	PUNCT
ecletica-1352	41	27	,	,	PUNCT
ecletica-1352	41	28	ni(ii	ni(ii	PROPN
ecletica-1352	41	29	)	)	PUNCT
ecletica-1352	41	30	,	,	PUNCT
ecletica-1352	41	31	cu(ii	cu(ii	PROPN
ecletica-1352	41	32	)	)	PUNCT
ecletica-1352	41	33	,	,	PUNCT
ecletica-1352	41	34	zn(ii	zn(ii	NUM
ecletica-1352	41	35	)	)	PUNCT
ecletica-1352	41	36	,	,	PUNCT
ecletica-1352	41	37	cd(ii	cd(ii	PROPN
ecletica-1352	41	38	)	)	PUNCT
ecletica-1352	41	39	,	,	PUNCT
ecletica-1352	41	40	and	and	CCONJ
ecletica-1352	41	41	hg(ii	hg(ii	PROPN
ecletica-1352	41	42	)	)	PUNCT
ecletica-1352	41	43	,	,	PUNCT
ecletica-1352	41	44	and	and	CCONJ
ecletica-1352	41	45	found	find	VERB
ecletica-1352	41	46	that	that	SCONJ
ecletica-1352	41	47	cu(ii	cu(ii	PROPN
ecletica-1352	41	48	)	)	PUNCT
ecletica-1352	41	49	demonstrated	demonstrate	VERB
ecletica-1352	41	50	excellent	excellent	ADJ
ecletica-1352	41	51	antibacterial	antibacterial	ADJ
ecletica-1352	41	52	and	and	CCONJ
ecletica-1352	41	53	antifungal	antifungal	ADJ
ecletica-1352	41	54	activities	activity	NOUN
ecletica-1352	41	55	when	when	SCONJ
ecletica-1352	41	56	compared	compare	VERB
ecletica-1352	41	57	to	to	ADP
ecletica-1352	41	58	other	other	ADJ
ecletica-1352	41	59	studied	study	VERB
ecletica-1352	41	60	metals	metal	NOUN
ecletica-1352	41	61	.	.	PUNCT
ecletica-1352	42	1	in	in	ADP
ecletica-1352	42	2	this	this	DET
ecletica-1352	42	3	investigation	investigation	NOUN
ecletica-1352	42	4	,	,	PUNCT
ecletica-1352	42	5	a	a	DET
ecletica-1352	42	6	cadmium	cadmium	NOUN
ecletica-1352	42	7	mof	mof	NOUN
ecletica-1352	42	8	was	be	AUX
ecletica-1352	42	9	synthesized	synthesize	VERB
ecletica-1352	42	10	,	,	PUNCT
ecletica-1352	42	11	described	describe	VERB
ecletica-1352	42	12	,	,	PUNCT
ecletica-1352	42	13	and	and	CCONJ
ecletica-1352	42	14	dft	dft	PROPN
ecletica-1352	42	15	studies	study	NOUN
ecletica-1352	42	16	were	be	AUX
ecletica-1352	42	17	undertaken	undertake	VERB
ecletica-1352	42	18	to	to	PART
ecletica-1352	42	19	ascertain	ascertain	VERB
ecletica-1352	42	20	the	the	DET
ecletica-1352	42	21	molecule	molecule	NOUN
ecletica-1352	42	22	’s	’s	PART
ecletica-1352	42	23	overall	overall	ADJ
ecletica-1352	42	24	reactivity	reactivity	NOUN
ecletica-1352	42	25	and	and	CCONJ
ecletica-1352	42	26	stability	stability	NOUN
ecletica-1352	42	27	.	.	PUNCT
ecletica-1352	43	1	the	the	DET
ecletica-1352	43	2	atomic	atomic	ADJ
ecletica-1352	43	3	charges	charge	NOUN
ecletica-1352	43	4	on	on	ADP
ecletica-1352	43	5	the	the	DET
ecletica-1352	43	6	cadmium	cadmium	NOUN
ecletica-1352	43	7	mof	mof	NOUN
ecletica-1352	43	8	have	have	AUX
ecletica-1352	43	9	been	be	AUX
ecletica-1352	43	10	researched	research	VERB
ecletica-1352	43	11	and	and	CCONJ
ecletica-1352	43	12	plotted	plot	VERB
ecletica-1352	43	13	together	together	ADV
ecletica-1352	43	14	with	with	ADP
ecletica-1352	43	15	the	the	DET
ecletica-1352	43	16	intercharge	intercharge	NOUN
ecletica-1352	43	17	transfer	transfer	NOUN
ecletica-1352	43	18	inside	inside	ADP
ecletica-1352	43	19	the	the	DET
ecletica-1352	43	20	mof	mof	NOUN
ecletica-1352	43	21	by	by	ADP
ecletica-1352	43	22	the	the	DET
ecletica-1352	43	23	natural	natural	ADJ
ecletica-1352	43	24	bond	bond	NOUN
ecletica-1352	43	25	orbital	orbital	NOUN
ecletica-1352	43	26	(	(	PUNCT
ecletica-1352	43	27	nbo	nbo	NOUN
ecletica-1352	43	28	)	)	PUNCT
ecletica-1352	43	29	analysis	analysis	NOUN
ecletica-1352	43	30	,	,	PUNCT
ecletica-1352	43	31	and	and	CCONJ
ecletica-1352	43	32	the	the	DET
ecletica-1352	43	33	molecular	molecular	ADJ
ecletica-1352	43	34	characteristics	characteristic	NOUN
ecletica-1352	43	35	of	of	ADP
ecletica-1352	43	36	the	the	DET
ecletica-1352	43	37	cadmium	cadmium	NOUN
ecletica-1352	43	38	mof	mof	NOUN
ecletica-1352	43	39	have	have	AUX
ecletica-1352	43	40	been	be	AUX
ecletica-1352	43	41	reported	report	VERB
ecletica-1352	43	42	.	.	PUNCT
ecletica-1352	44	1	in	in	ADP
ecletica-1352	44	2	order	order	NOUN
ecletica-1352	44	3	to	to	PART
ecletica-1352	44	4	better	well	ADV
ecletica-1352	44	5	understand	understand	VERB
ecletica-1352	44	6	the	the	DET
ecletica-1352	44	7	binding	bind	VERB
ecletica-1352	44	8	activity	activity	NOUN
ecletica-1352	44	9	,	,	PUNCT
ecletica-1352	44	10	molecular	molecular	ADJ
ecletica-1352	44	11	docking	docking	NOUN
ecletica-1352	44	12	was	be	AUX
ecletica-1352	44	13	also	also	ADV
ecletica-1352	44	14	carried	carry	VERB
ecletica-1352	44	15	out	out	ADP
ecletica-1352	44	16	using	use	VERB
ecletica-1352	44	17	the	the	DET
ecletica-1352	44	18	antimicrobial	antimicrobial	ADJ
ecletica-1352	44	19	proteins	protein	NOUN
ecletica-1352	44	20	1d7u	1d7u	NUM
ecletica-1352	44	21	and	and	CCONJ
ecletica-1352	44	22	2xcs	2xcs	NUM
ecletica-1352	44	23	in	in	ADP
ecletica-1352	44	24	combination	combination	NOUN
ecletica-1352	44	25	with	with	ADP
ecletica-1352	44	26	the	the	DET
ecletica-1352	44	27	cadmium	cadmium	NOUN
ecletica-1352	44	28	mof	mof	NOUN
ecletica-1352	44	29	.	.	PUNCT
ecletica-1352	45	1	however	however	ADV
ecletica-1352	45	2	,	,	PUNCT
ecletica-1352	45	3	in	in	ADP
ecletica-1352	45	4	-	-	PUNCT
ecletica-1352	45	5	silico	silico	NOUN
ecletica-1352	45	6	absorption	absorption	NOUN
ecletica-1352	45	7	,	,	PUNCT
ecletica-1352	45	8	distribution	distribution	NOUN
ecletica-1352	45	9	,	,	PUNCT
ecletica-1352	45	10	metabolism	metabolism	NOUN
ecletica-1352	45	11	,	,	PUNCT
ecletica-1352	45	12	excretion	excretion	NOUN
ecletica-1352	45	13	,	,	PUNCT
ecletica-1352	45	14	and	and	CCONJ
ecletica-1352	45	15	toxicity	toxicity	NOUN
ecletica-1352	45	16	(	(	PUNCT
ecletica-1352	45	17	admet	admet	PROPN
ecletica-1352	45	18	)	)	PUNCT
ecletica-1352	45	19	research	research	NOUN
ecletica-1352	45	20	has	have	AUX
ecletica-1352	45	21	been	be	AUX
ecletica-1352	45	22	presented	present	VERB
ecletica-1352	45	23	here	here	ADV
ecletica-1352	45	24	to	to	PART
ecletica-1352	45	25	support	support	VERB
ecletica-1352	45	26	the	the	DET
ecletica-1352	45	27	docking	docking	NOUN
ecletica-1352	45	28	findings	finding	NOUN
ecletica-1352	45	29	and	and	CCONJ
ecletica-1352	45	30	take	take	VERB
ecletica-1352	45	31	into	into	ADP
ecletica-1352	45	32	account	account	NOUN
ecletica-1352	45	33	the	the	DET
ecletica-1352	45	34	bioactive	bioactive	PROPN
ecletica-1352	45	35	molecule	molecule	NOUN
ecletica-1352	45	36	’s	’s	PART
ecletica-1352	45	37	position	position	NOUN
ecletica-1352	45	38	inside	inside	ADP
ecletica-1352	45	39	the	the	DET
ecletica-1352	45	40	mof	mof	ADJ
ecletica-1352	45	41	structure	structure	NOUN
ecletica-1352	45	42	.	.	PUNCT
ecletica-1352	46	1	2	2	X
ecletica-1352	46	2	.	.	X
ecletica-1352	46	3	materials	material	NOUN
ecletica-1352	46	4	and	and	CCONJ
ecletica-1352	46	5	methods	method	NOUN
ecletica-1352	46	6	2.1	2.1	NUM
ecletica-1352	46	7	materials	material	NOUN
ecletica-1352	46	8	cadmium	cadmium	NOUN
ecletica-1352	46	9	nitrate	nitrate	NOUN
ecletica-1352	46	10	tetrahydrate	tetrahydrate	NOUN
ecletica-1352	46	11	(	(	PUNCT
ecletica-1352	46	12	bdh	bdh	PROPN
ecletica-1352	46	13	chemicals	chemicals	PROPN
ecletica-1352	46	14	ltd	ltd	PROPN
ecletica-1352	46	15	,	,	PUNCT
ecletica-1352	46	16	98	98	NUM
ecletica-1352	46	17	%	%	NOUN
ecletica-1352	46	18	)	)	PUNCT
ecletica-1352	46	19	–	–	PUNCT
ecletica-1352	46	20	cd(no3)2∙4h2o	cd(no3)2∙4h2o	NOUN
ecletica-1352	46	21	;	;	PUNCT
ecletica-1352	46	22	ethanol	ethanol	NOUN
ecletica-1352	46	23	(	(	PUNCT
ecletica-1352	46	24	bdh	bdh	PROPN
ecletica-1352	46	25	chemicals	chemicals	PROPN
ecletica-1352	46	26	ltd	ltd	PROPN
ecletica-1352	46	27	,	,	PUNCT
ecletica-1352	46	28	99	99	NUM
ecletica-1352	46	29	%	%	NOUN
ecletica-1352	46	30	)	)	PUNCT
ecletica-1352	46	31	,	,	PUNCT
ecletica-1352	46	32	benzene-1,3,5	benzene-1,3,5	NOUN
ecletica-1352	46	33	-	-	PUNCT
ecletica-1352	46	34	tricarboxylic	tricarboxylic	ADJ
ecletica-1352	46	35	acid	acid	NOUN
ecletica-1352	46	36	–	–	PUNCT
ecletica-1352	46	37	h2btc	h2btc	NUM
ecletica-1352	46	38	,	,	PUNCT
ecletica-1352	46	39	(	(	PUNCT
ecletica-1352	46	40	alfa	alfa	PROPN
ecletica-1352	46	41	aesar	aesar	PROPN
ecletica-1352	46	42	,	,	PUNCT
ecletica-1352	46	43	99	99	NUM
ecletica-1352	46	44	%	%	NOUN
ecletica-1352	46	45	purity	purity	NOUN
ecletica-1352	46	46	)	)	PUNCT
ecletica-1352	46	47	and	and	CCONJ
ecletica-1352	46	48	deionized	deionize	VERB
ecletica-1352	46	49	water	water	NOUN
ecletica-1352	46	50	(	(	PUNCT
ecletica-1352	46	51	h2o	h2o	PROPN
ecletica-1352	46	52	)	)	PUNCT
ecletica-1352	46	53	.	.	PUNCT
ecletica-1352	47	1	2.2	2.2	NUM
ecletica-1352	47	2	experimental	experimental	ADJ
ecletica-1352	47	3	procedure	procedure	NOUN
ecletica-1352	47	4	2.2.1	2.2.1	NUM
ecletica-1352	47	5	synthesis	synthesis	NOUN
ecletica-1352	47	6	of	of	ADP
ecletica-1352	47	7	[	[	X
ecletica-1352	47	8	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	47	9	the	the	DET
ecletica-1352	47	10	compound	compound	NOUN
ecletica-1352	47	11	was	be	AUX
ecletica-1352	47	12	synthesized	synthesize	VERB
ecletica-1352	47	13	from	from	ADP
ecletica-1352	47	14	a	a	DET
ecletica-1352	47	15	solution	solution	NOUN
ecletica-1352	47	16	mixture	mixture	NOUN
ecletica-1352	47	17	of	of	ADP
ecletica-1352	47	18	cadmium	cadmium	NOUN
ecletica-1352	47	19	nitrate	nitrate	NOUN
ecletica-1352	47	20	tetrahydrate	tetrahydrate	NOUN
ecletica-1352	47	21	cd(no3)2∙4h2o	cd(no3)2∙4h2o	PROPN
ecletica-1352	47	22	(	(	PUNCT
ecletica-1352	47	23	1.2003	1.2003	NUM
ecletica-1352	47	24	g	g	NOUN
ecletica-1352	47	25	,	,	PUNCT
ecletica-1352	47	26	1.0	1.0	NUM
ecletica-1352	47	27	mmol	mmol	NOUN
ecletica-1352	47	28	)	)	PUNCT
ecletica-1352	47	29	and	and	CCONJ
ecletica-1352	47	30	1,3,5	1,3,5	NUM
ecletica-1352	47	31	-	-	PUNCT
ecletica-1352	47	32	benzene	benzene	NOUN
ecletica-1352	47	33	tricarboxylic	tricarboxylic	ADJ
ecletica-1352	47	34	acid	acid	NOUN
ecletica-1352	47	35	c9h6o6	c9h6o6	NOUN
ecletica-1352	47	36	(	(	PUNCT
ecletica-1352	47	37	0.8456	0.8456	NUM
ecletica-1352	47	38	g	g	NOUN
ecletica-1352	47	39	,	,	PUNCT
ecletica-1352	47	40	1.0	1.0	NUM
ecletica-1352	47	41	mmol	mmol	NOUN
ecletica-1352	47	42	)	)	PUNCT
ecletica-1352	47	43	using	use	VERB
ecletica-1352	47	44	ethanol	ethanol	NOUN
ecletica-1352	47	45	and	and	CCONJ
ecletica-1352	47	46	deionized	deionize	VERB
ecletica-1352	47	47	water	water	NOUN
ecletica-1352	47	48	as	as	ADP
ecletica-1352	47	49	solvent	solvent	NOUN
ecletica-1352	47	50	in	in	ADP
ecletica-1352	47	51	the	the	DET
ecletica-1352	47	52	ratio	ratio	NOUN
ecletica-1352	47	53	of	of	ADP
ecletica-1352	47	54	2:1	2:1	NUM
ecletica-1352	47	55	(	(	PUNCT
ecletica-1352	47	56	5.2:2.6	5.2:2.6	NUM
ecletica-1352	47	57	cm3	cm3	NOUN
ecletica-1352	47	58	)	)	PUNCT
ecletica-1352	47	59	.	.	PUNCT
ecletica-1352	48	1	the	the	DET
ecletica-1352	48	2	reaction	reaction	NOUN
ecletica-1352	48	3	mixture	mixture	NOUN
ecletica-1352	48	4	was	be	AUX
ecletica-1352	48	5	stirred	stir	VERB
ecletica-1352	48	6	for	for	ADP
ecletica-1352	48	7	20	20	NUM
ecletica-1352	48	8	min	min	NOUN
ecletica-1352	48	9	to	to	PART
ecletica-1352	48	10	obtain	obtain	VERB
ecletica-1352	48	11	a	a	DET
ecletica-1352	48	12	complete	complete	ADJ
ecletica-1352	48	13	miscible	miscible	ADJ
ecletica-1352	48	14	solution	solution	NOUN
ecletica-1352	48	15	before	before	ADP
ecletica-1352	48	16	transferring	transfer	VERB
ecletica-1352	48	17	into	into	ADP
ecletica-1352	48	18	an	an	DET
ecletica-1352	48	19	ace	ace	NOUN
ecletica-1352	48	20	pressure	pressure	NOUN
ecletica-1352	48	21	glass	glass	NOUN
ecletica-1352	48	22	tube	tube	NOUN
ecletica-1352	48	23	and	and	CCONJ
ecletica-1352	48	24	heated	heat	VERB
ecletica-1352	48	25	in	in	ADP
ecletica-1352	48	26	an	an	DET
ecletica-1352	48	27	oven	oven	NOUN
ecletica-1352	48	28	at	at	ADP
ecletica-1352	48	29	a	a	DET
ecletica-1352	48	30	temperature	temperature	NOUN
ecletica-1352	48	31	of	of	ADP
ecletica-1352	48	32	120	120	NUM
ecletica-1352	48	33	°	°	NOUN
ecletica-1352	48	34	c	c	NOUN
ecletica-1352	48	35	for	for	ADP
ecletica-1352	48	36	24	24	NUM
ecletica-1352	48	37	h.	h.	PROPN
ecletica-1352	48	38	a	a	DET
ecletica-1352	48	39	crop	crop	NOUN
ecletica-1352	48	40	of	of	ADP
ecletica-1352	48	41	colourless	colourless	ADJ
ecletica-1352	48	42	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	NOUN
ecletica-1352	48	43	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	48	44	original	original	ADJ
ecletica-1352	48	45	article	article	NOUN
ecletica-1352	48	46	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	48	47	39	39	NUM
ecletica-1352	48	48	eclética	eclética	PROPN
ecletica-1352	48	49	química	química	PROPN
ecletica-1352	48	50	journal	journal	PROPN
ecletica-1352	48	51	,	,	PUNCT
ecletica-1352	48	52	vol	vol	NOUN
ecletica-1352	48	53	.	.	PROPN
ecletica-1352	48	54	47	47	NUM
ecletica-1352	48	55	,	,	PUNCT
ecletica-1352	48	56	n.	n.	NOUN
ecletica-1352	48	57	4	4	NUM
ecletica-1352	48	58	,	,	PUNCT
ecletica-1352	48	59	2022	2022	NUM
ecletica-1352	48	60	,	,	PUNCT
ecletica-1352	48	61	37	37	NUM
ecletica-1352	48	62	-	-	SYM
ecletica-1352	48	63	50	50	NUM
ecletica-1352	48	64	issn	issn	NOUN
ecletica-1352	48	65	:	:	PUNCT
ecletica-1352	48	66	1678	1678	NUM
ecletica-1352	48	67	-	-	SYM
ecletica-1352	48	68	4618	4618	NUM
ecletica-1352	48	69	doi	doi	NOUN
ecletica-1352	48	70	:	:	PUNCT
ecletica-1352	48	71	10.26850/1678	10.26850/1678	NUM
ecletica-1352	48	72	-	-	PUNCT
ecletica-1352	48	73	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	48	74	-	-	PUNCT
ecletica-1352	48	75	50	50	NUM
ecletica-1352	48	76	crystalline	crystalline	NOUN
ecletica-1352	48	77	material	material	NOUN
ecletica-1352	48	78	was	be	AUX
ecletica-1352	48	79	obtained	obtain	VERB
ecletica-1352	48	80	on	on	ADP
ecletica-1352	48	81	cooling	cool	VERB
ecletica-1352	48	82	by	by	ADP
ecletica-1352	48	83	filtration	filtration	NOUN
ecletica-1352	48	84	and	and	CCONJ
ecletica-1352	48	85	washed	wash	VERB
ecletica-1352	48	86	with	with	ADP
ecletica-1352	48	87	distilled	distil	VERB
ecletica-1352	48	88	water	water	NOUN
ecletica-1352	48	89	and	and	CCONJ
ecletica-1352	48	90	air	air	NOUN
ecletica-1352	48	91	dried	dry	VERB
ecletica-1352	48	92	.	.	PUNCT
ecletica-1352	49	1	2.3	2.3	NUM
ecletica-1352	49	2	crystal	crystal	NOUN
ecletica-1352	49	3	structure	structure	NOUN
ecletica-1352	49	4	determination	determination	NOUN
ecletica-1352	49	5	2.3.1	2.3.1	NUM
ecletica-1352	49	6	crystal	crystal	NOUN
ecletica-1352	49	7	structure	structure	NOUN
ecletica-1352	49	8	determination	determination	NOUN
ecletica-1352	49	9	of	of	ADP
ecletica-1352	49	10	[	[	X
ecletica-1352	49	11	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	49	12	a	a	DET
ecletica-1352	49	13	suitable	suitable	ADJ
ecletica-1352	49	14	crystal	crystal	NOUN
ecletica-1352	49	15	was	be	AUX
ecletica-1352	49	16	selected	select	VERB
ecletica-1352	49	17	and	and	CCONJ
ecletica-1352	49	18	mounted	mount	VERB
ecletica-1352	49	19	on	on	ADP
ecletica-1352	49	20	a	a	DET
ecletica-1352	49	21	gva	gva	PROPN
ecletica-1352	49	22	,	,	PUNCT
ecletica-1352	49	23	pl13110002	pl13110002	PROPN
ecletica-1352	49	24	diffractometer	diffractometer	NOUN
ecletica-1352	49	25	.	.	PUNCT
ecletica-1352	50	1	the	the	DET
ecletica-1352	50	2	crystal	crystal	NOUN
ecletica-1352	50	3	was	be	AUX
ecletica-1352	50	4	kept	keep	VERB
ecletica-1352	50	5	at	at	ADP
ecletica-1352	50	6	120	120	NUM
ecletica-1352	50	7	k	k	NOUN
ecletica-1352	50	8	during	during	ADP
ecletica-1352	50	9	data	data	NOUN
ecletica-1352	50	10	collection	collection	NOUN
ecletica-1352	50	11	using	use	VERB
ecletica-1352	50	12	olex2	olex2	PROPN
ecletica-1352	51	1	(	(	PUNCT
ecletica-1352	51	2	mason	mason	PROPN
ecletica-1352	51	3	et	et	PROPN
ecletica-1352	51	4	al	al	PROPN
ecletica-1352	51	5	.	.	PROPN
ecletica-1352	51	6	,	,	PUNCT
ecletica-1352	51	7	2016	2016	NUM
ecletica-1352	51	8	)	)	PUNCT
ecletica-1352	51	9	,	,	PUNCT
ecletica-1352	51	10	the	the	DET
ecletica-1352	51	11	structure	structure	NOUN
ecletica-1352	51	12	was	be	AUX
ecletica-1352	51	13	solved	solve	VERB
ecletica-1352	51	14	with	with	ADP
ecletica-1352	51	15	the	the	DET
ecletica-1352	51	16	shelxt	shelxt	NOUN
ecletica-1352	51	17	(	(	PUNCT
ecletica-1352	51	18	sevvana	sevvana	NOUN
ecletica-1352	51	19	et	et	PROPN
ecletica-1352	51	20	al	al	PROPN
ecletica-1352	51	21	.	.	PROPN
ecletica-1352	51	22	,	,	PUNCT
ecletica-1352	51	23	2019	2019	NUM
ecletica-1352	51	24	)	)	PUNCT
ecletica-1352	51	25	structure	structure	NOUN
ecletica-1352	51	26	solution	solution	NOUN
ecletica-1352	51	27	program	program	NOUN
ecletica-1352	51	28	using	use	VERB
ecletica-1352	51	29	intrinsic	intrinsic	ADJ
ecletica-1352	51	30	phasing	phasing	NOUN
ecletica-1352	51	31	and	and	CCONJ
ecletica-1352	51	32	refined	refine	VERB
ecletica-1352	51	33	with	with	ADP
ecletica-1352	51	34	the	the	DET
ecletica-1352	51	35	shelxl	shelxl	NOUN
ecletica-1352	51	36	(	(	PUNCT
ecletica-1352	51	37	shemchuk	shemchuk	NOUN
ecletica-1352	51	38	et	et	PROPN
ecletica-1352	51	39	al	al	PROPN
ecletica-1352	51	40	.	.	PROPN
ecletica-1352	51	41	,	,	PUNCT
ecletica-1352	51	42	2020	2020	NUM
ecletica-1352	51	43	)	)	PUNCT
ecletica-1352	51	44	refinement	refinement	NOUN
ecletica-1352	51	45	package	package	NOUN
ecletica-1352	51	46	using	use	VERB
ecletica-1352	51	47	least	least	ADJ
ecletica-1352	51	48	squares	square	NOUN
ecletica-1352	51	49	minimization	minimization	NOUN
ecletica-1352	51	50	.	.	PUNCT
ecletica-1352	52	1	crystal	crystal	NOUN
ecletica-1352	52	2	data	datum	NOUN
ecletica-1352	52	3	for	for	ADP
ecletica-1352	52	4	[	[	PUNCT
ecletica-1352	52	5	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	52	6	is	be	AUX
ecletica-1352	52	7	shown	show	VERB
ecletica-1352	52	8	in	in	ADP
ecletica-1352	52	9	tab	tab	NOUN
ecletica-1352	52	10	.	.	PUNCT
ecletica-1352	53	1	1	1	X
ecletica-1352	53	2	.	.	X
ecletica-1352	53	3	table	table	NOUN
ecletica-1352	53	4	1	1	NUM
ecletica-1352	53	5	.	.	PUNCT
ecletica-1352	54	1	crystal	crystal	NOUN
ecletica-1352	54	2	data	datum	NOUN
ecletica-1352	54	3	and	and	CCONJ
ecletica-1352	54	4	structure	structure	NOUN
ecletica-1352	54	5	refinement	refinement	NOUN
ecletica-1352	54	6	for	for	ADP
ecletica-1352	54	7	[	[	NOUN
ecletica-1352	54	8	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	54	9	.	.	PUNCT
ecletica-1352	55	1	identification	identification	NOUN
ecletica-1352	55	2	code	code	NOUN
ecletica-1352	55	3	cdjooe	cdjooe	ADJ
ecletica-1352	55	4	empirical	empirical	ADJ
ecletica-1352	55	5	formula	formula	NOUN
ecletica-1352	55	6	c9h8cdo8	c9h8cdo8	NOUN
ecletica-1352	55	7	formula	formula	VERB
ecletica-1352	55	8	weight	weight	NOUN
ecletica-1352	55	9	356.55	356.55	NUM
ecletica-1352	55	10	temperature	temperature	NOUN
ecletica-1352	55	11	(	(	PUNCT
ecletica-1352	55	12	k	k	NOUN
ecletica-1352	55	13	)	)	PUNCT
ecletica-1352	55	14	120(2	120(2	NUM
ecletica-1352	55	15	)	)	PUNCT
ecletica-1352	55	16	crystal	crystal	NOUN
ecletica-1352	55	17	system	system	NOUN
ecletica-1352	55	18	monoclinic	monoclinic	ADJ
ecletica-1352	55	19	space	space	NOUN
ecletica-1352	55	20	group	group	NOUN
ecletica-1352	55	21	i2	i2	PROPN
ecletica-1352	55	22	/	/	SYM
ecletica-1352	55	23	a	a	DET
ecletica-1352	55	24	a	a	PRON
ecletica-1352	55	25	(	(	PUNCT
ecletica-1352	55	26	å	å	NOUN
ecletica-1352	55	27	)	)	PUNCT
ecletica-1352	55	28	13.1508(3	13.1508(3	NUM
ecletica-1352	55	29	)	)	PUNCT
ecletica-1352	55	30	b	b	PROPN
ecletica-1352	55	31	(	(	PUNCT
ecletica-1352	55	32	å	å	NOUN
ecletica-1352	55	33	)	)	PUNCT
ecletica-1352	55	34	9.1014(2	9.1014(2	NUM
ecletica-1352	55	35	)	)	PUNCT
ecletica-1352	56	1	c	c	NOUN
ecletica-1352	56	2	(	(	PUNCT
ecletica-1352	56	3	å	å	NOUN
ecletica-1352	56	4	)	)	PUNCT
ecletica-1352	56	5	17.8971(4	17.8971(4	NUM
ecletica-1352	56	6	)	)	PUNCT
ecletica-1352	56	7	α	α	PROPN
ecletica-1352	56	8	(	(	PUNCT
ecletica-1352	56	9	°	°	PROPN
ecletica-1352	56	10	)	)	PUNCT
ecletica-1352	56	11	90	90	NUM
ecletica-1352	56	12	β	β	X
ecletica-1352	56	13	(	(	PUNCT
ecletica-1352	56	14	°	°	PROPN
ecletica-1352	56	15	)	)	PUNCT
ecletica-1352	56	16	103.455(2	103.455(2	NOUN
ecletica-1352	56	17	)	)	PUNCT
ecletica-1352	56	18	γ	γ	PROPN
ecletica-1352	56	19	(	(	PUNCT
ecletica-1352	56	20	°	°	PROPN
ecletica-1352	56	21	)	)	PUNCT
ecletica-1352	56	22	90	90	NUM
ecletica-1352	56	23	volume	volume	NOUN
ecletica-1352	56	24	(	(	PUNCT
ecletica-1352	56	25	å3	å3	PROPN
ecletica-1352	56	26	)	)	PUNCT
ecletica-1352	56	27	2,083.32(8	2,083.32(8	NUM
ecletica-1352	56	28	)	)	PUNCT
ecletica-1352	56	29	z	z	NOUN
ecletica-1352	56	30	8	8	NUM
ecletica-1352	56	31	ρcalcg	ρcalcg	NOUN
ecletica-1352	56	32	(	(	PUNCT
ecletica-1352	56	33	cm3	cm3	NOUN
ecletica-1352	56	34	)	)	PUNCT
ecletica-1352	56	35	2.274	2.274	NUM
ecletica-1352	56	36	μ	μ	NOUN
ecletica-1352	56	37	(	(	PUNCT
ecletica-1352	56	38	mm–1	mm–1	PROPN
ecletica-1352	56	39	)	)	PUNCT
ecletica-1352	56	40	17.183	17.183	NUM
ecletica-1352	56	41	f(000	f(000	NOUN
ecletica-1352	56	42	)	)	PUNCT
ecletica-1352	56	43	1,392.0	1,392.0	NUM
ecletica-1352	56	44	crystal	crystal	NOUN
ecletica-1352	56	45	size	size	NOUN
ecletica-1352	56	46	(	(	PUNCT
ecletica-1352	56	47	mm3	mm3	PROPN
ecletica-1352	56	48	)	)	PUNCT
ecletica-1352	56	49	0.521	0.521	NUM
ecletica-1352	56	50	×	×	NOUN
ecletica-1352	56	51	0.159	0.159	NUM
ecletica-1352	56	52	×	×	NOUN
ecletica-1352	56	53	0.149	0.149	NUM
ecletica-1352	56	54	radiation	radiation	NOUN
ecletica-1352	56	55	cu	cu	NOUN
ecletica-1352	56	56	kα	kα	NOUN
ecletica-1352	56	57	(	(	PUNCT
ecletica-1352	56	58	λ	λ	X
ecletica-1352	56	59	=	=	NOUN
ecletica-1352	56	60	1.54184	1.54184	NUM
ecletica-1352	56	61	)	)	PUNCT
ecletica-1352	56	62	2θ	2θ	NUM
ecletica-1352	56	63	range	range	VERB
ecletica-1352	56	64	for	for	ADP
ecletica-1352	56	65	data	data	NOUN
ecletica-1352	56	66	collection	collection	NOUN
ecletica-1352	56	67	(	(	PUNCT
ecletica-1352	56	68	°	°	ADP
ecletica-1352	56	69	)	)	PUNCT
ecletica-1352	56	70	10.164	10.164	NUM
ecletica-1352	56	71	to	to	ADP
ecletica-1352	56	72	144.642	144.642	NUM
ecletica-1352	56	73	index	index	NOUN
ecletica-1352	56	74	ranges	range	VERB
ecletica-1352	56	75	–	–	PUNCT
ecletica-1352	56	76	16	16	NUM
ecletica-1352	56	77	≤	≤	NUM
ecletica-1352	56	78	h	h	NOUN
ecletica-1352	56	79	≤	≤	NOUN
ecletica-1352	56	80	13	13	NUM
ecletica-1352	56	81	,	,	PUNCT
ecletica-1352	56	82	–	–	PUNCT
ecletica-1352	56	83	7	7	NUM
ecletica-1352	56	84	≤	≤	NUM
ecletica-1352	57	1	k	k	X
ecletica-1352	57	2	≤	≤	NUM
ecletica-1352	57	3	11	11	NUM
ecletica-1352	57	4	,	,	PUNCT
ecletica-1352	57	5	–	–	PUNCT
ecletica-1352	57	6	21	21	NUM
ecletica-1352	57	7	≤	≤	NUM
ecletica-1352	57	8	l	l	NOUN
ecletica-1352	57	9	≤	≤	NUM
ecletica-1352	57	10	22	22	NUM
ecletica-1352	57	11	reflections	reflection	NOUN
ecletica-1352	57	12	collected	collect	VERB
ecletica-1352	57	13	3,976	3,976	NUM
ecletica-1352	57	14	independent	independent	ADJ
ecletica-1352	57	15	reflections	reflection	NOUN
ecletica-1352	57	16	2005	2005	NUM
ecletica-1352	57	17	[	[	X
ecletica-1352	57	18	rint	rint	NOUN
ecletica-1352	57	19	=	=	SYM
ecletica-1352	57	20	0.0264	0.0264	NUM
ecletica-1352	57	21	,	,	PUNCT
ecletica-1352	57	22	rsigma	rsigma	ADJ
ecletica-1352	57	23	=	=	SYM
ecletica-1352	57	24	0.0273	0.0273	NUM
ecletica-1352	57	25	]	]	X
ecletica-1352	57	26	data	data	NOUN
ecletica-1352	57	27	/	/	SYM
ecletica-1352	57	28	restraints	restraint	NOUN
ecletica-1352	57	29	/	/	SYM
ecletica-1352	57	30	parameters	parameter	NOUN
ecletica-1352	57	31	2005/0/166	2005/0/166	NUM
ecletica-1352	57	32	goodness	goodness	NOUN
ecletica-1352	57	33	-	-	PUNCT
ecletica-1352	57	34	of	of	ADP
ecletica-1352	57	35	-	-	PUNCT
ecletica-1352	57	36	fit	fit	NOUN
ecletica-1352	57	37	on	on	ADP
ecletica-1352	57	38	f2	f2	PROPN
ecletica-1352	57	39	1.123	1.123	NUM
ecletica-1352	57	40	final	final	ADJ
ecletica-1352	57	41	r	r	NOUN
ecletica-1352	57	42	indexes	index	NOUN
ecletica-1352	58	1	[	[	X
ecletica-1352	58	2	i	i	PRON
ecletica-1352	58	3	≥	≥	VERB
ecletica-1352	58	4	2σ	2σ	NUM
ecletica-1352	58	5	(	(	PUNCT
ecletica-1352	58	6	i	i	NOUN
ecletica-1352	58	7	)	)	PUNCT
ecletica-1352	58	8	]	]	PUNCT
ecletica-1352	58	9	r1	r1	PROPN
ecletica-1352	58	10	=	=	PUNCT
ecletica-1352	58	11	0.0321	0.0321	NUM
ecletica-1352	58	12	,	,	PUNCT
ecletica-1352	58	13	wr2	wr2	PROPN
ecletica-1352	58	14	=	=	PROPN
ecletica-1352	58	15	0.0894	0.0894	NUM
ecletica-1352	58	16	final	final	ADJ
ecletica-1352	58	17	r	r	NOUN
ecletica-1352	58	18	indexes	index	NOUN
ecletica-1352	58	19	[	[	X
ecletica-1352	58	20	all	all	DET
ecletica-1352	58	21	data	datum	NOUN
ecletica-1352	58	22	]	]	PUNCT
ecletica-1352	58	23	r1	r1	PROPN
ecletica-1352	58	24	=	=	SYM
ecletica-1352	58	25	0.0325	0.0325	PROPN
ecletica-1352	58	26	,	,	PUNCT
ecletica-1352	58	27	wr2	wr2	PROPN
ecletica-1352	58	28	=	=	PROPN
ecletica-1352	58	29	0.0899	0.0899	NUM
ecletica-1352	58	30	largest	large	ADJ
ecletica-1352	58	31	diff	diff	NOUN
ecletica-1352	58	32	.	.	PUNCT
ecletica-1352	58	33	peak	peak	PROPN
ecletica-1352	58	34	/	/	SYM
ecletica-1352	58	35	hole	hole	NOUN
ecletica-1352	58	36	(	(	PUNCT
ecletica-1352	58	37	e	e	NOUN
ecletica-1352	58	38	å–3	å–3	NOUN
ecletica-1352	58	39	)	)	PUNCT
ecletica-1352	58	40	0.90/-1.33	0.90/-1.33	NOUN
ecletica-1352	58	41	2.4	2.4	NUM
ecletica-1352	58	42	computational	computational	ADJ
ecletica-1352	58	43	method	method	NOUN
ecletica-1352	58	44	all	all	DET
ecletica-1352	58	45	the	the	DET
ecletica-1352	58	46	computational	computational	ADJ
ecletica-1352	58	47	calculations	calculation	NOUN
ecletica-1352	58	48	in	in	ADP
ecletica-1352	58	49	this	this	DET
ecletica-1352	58	50	work	work	NOUN
ecletica-1352	58	51	have	have	AUX
ecletica-1352	58	52	been	be	AUX
ecletica-1352	58	53	carried	carry	VERB
ecletica-1352	58	54	out	out	ADP
ecletica-1352	58	55	using	use	VERB
ecletica-1352	58	56	the	the	DET
ecletica-1352	58	57	gaussian09w	gaussian09w	NOUN
ecletica-1352	58	58	and	and	CCONJ
ecletica-1352	58	59	gaussview	gaussview	NOUN
ecletica-1352	58	60	6.0.16	6.0.16	NUM
ecletica-1352	58	61	softwares	software	NOUN
ecletica-1352	58	62	(	(	PUNCT
ecletica-1352	58	63	dennington	dennington	NOUN
ecletica-1352	58	64	et	et	PROPN
ecletica-1352	58	65	al	al	PROPN
ecletica-1352	58	66	.	.	PROPN
ecletica-1352	58	67	,	,	PUNCT
ecletica-1352	58	68	2001	2001	NUM
ecletica-1352	58	69	;	;	PUNCT
ecletica-1352	58	70	frisch	frisch	VERB
ecletica-1352	58	71	et	et	PROPN
ecletica-1352	58	72	al	al	PROPN
ecletica-1352	58	73	.	.	PROPN
ecletica-1352	58	74	,	,	PUNCT
ecletica-1352	58	75	2016	2016	NUM
ecletica-1352	58	76	)	)	PUNCT
ecletica-1352	58	77	within	within	ADP
ecletica-1352	58	78	the	the	DET
ecletica-1352	58	79	framework	framework	NOUN
ecletica-1352	58	80	of	of	ADP
ecletica-1352	58	81	dft	dft	PROPN
ecletica-1352	58	82	.	.	PUNCT
ecletica-1352	59	1	the	the	DET
ecletica-1352	59	2	b3lyp	b3lyp	PROPN
ecletica-1352	59	3	functional	functional	ADJ
ecletica-1352	59	4	which	which	PRON
ecletica-1352	59	5	is	be	AUX
ecletica-1352	59	6	a	a	DET
ecletica-1352	59	7	combination	combination	NOUN
ecletica-1352	59	8	of	of	ADP
ecletica-1352	59	9	becke	becke	NOUN
ecletica-1352	59	10	’s	’s	PART
ecletica-1352	59	11	three	three	NUM
ecletica-1352	59	12	parameter	parameter	NOUN
ecletica-1352	59	13	exchange	exchange	NOUN
ecletica-1352	59	14	functional	functional	ADJ
ecletica-1352	59	15	(	(	PUNCT
ecletica-1352	59	16	b3	b3	PROPN
ecletica-1352	59	17	)	)	PUNCT
ecletica-1352	59	18	with	with	ADP
ecletica-1352	59	19	the	the	DET
ecletica-1352	59	20	nonlocal	nonlocal	ADJ
ecletica-1352	59	21	correlation	correlation	NOUN
ecletica-1352	59	22	functional	functional	ADJ
ecletica-1352	59	23	of	of	ADP
ecletica-1352	59	24	lee	lee	PROPN
ecletica-1352	59	25	,	,	PUNCT
ecletica-1352	59	26	yang	yang	PROPN
ecletica-1352	59	27	,	,	PUNCT
ecletica-1352	59	28	and	and	CCONJ
ecletica-1352	59	29	parr	parr	X
ecletica-1352	59	30	(	(	PUNCT
ecletica-1352	59	31	lyp	lyp	PROPN
ecletica-1352	59	32	)	)	PUNCT
ecletica-1352	59	33	assigning	assign	VERB
ecletica-1352	59	34	the	the	DET
ecletica-1352	59	35	6	6	NUM
ecletica-1352	59	36	-	-	SYM
ecletica-1352	59	37	311++g	311++g	NUM
ecletica-1352	59	38	(	(	PUNCT
ecletica-1352	59	39	d	d	PROPN
ecletica-1352	59	40	,	,	PUNCT
ecletica-1352	59	41	p	p	NOUN
ecletica-1352	59	42	)	)	PUNCT
ecletica-1352	59	43	and	and	CCONJ
ecletica-1352	59	44	the	the	DET
ecletica-1352	59	45	lanl2dz	lanl2dz	NOUN
ecletica-1352	59	46	basis	basis	NOUN
ecletica-1352	59	47	set	set	NOUN
ecletica-1352	59	48	was	be	AUX
ecletica-1352	59	49	used	use	VERB
ecletica-1352	59	50	for	for	ADP
ecletica-1352	59	51	the	the	DET
ecletica-1352	59	52	lighter	light	ADJ
ecletica-1352	59	53	(	(	PUNCT
ecletica-1352	59	54	h	h	NOUN
ecletica-1352	59	55	,	,	PUNCT
ecletica-1352	59	56	c	c	NOUN
ecletica-1352	59	57	,	,	PUNCT
ecletica-1352	59	58	o	o	NOUN
ecletica-1352	59	59	)	)	PUNCT
ecletica-1352	59	60	and	and	CCONJ
ecletica-1352	59	61	heavy	heavy	ADJ
ecletica-1352	59	62	elements	element	NOUN
ecletica-1352	59	63	respectively	respectively	ADV
ecletica-1352	59	64	.	.	PUNCT
ecletica-1352	60	1	the	the	DET
ecletica-1352	60	2	ground	ground	NOUN
ecletica-1352	60	3	state	state	NOUN
ecletica-1352	60	4	optimization	optimization	NOUN
ecletica-1352	60	5	was	be	AUX
ecletica-1352	60	6	carried	carry	VERB
ecletica-1352	60	7	out	out	ADP
ecletica-1352	60	8	at	at	ADP
ecletica-1352	60	9	singlet	singlet	ADJ
ecletica-1352	60	10	state	state	NOUN
ecletica-1352	60	11	with	with	ADP
ecletica-1352	60	12	a	a	DET
ecletica-1352	60	13	positive	positive	ADJ
ecletica-1352	60	14	charge	charge	NOUN
ecletica-1352	60	15	+1	+1	PROPN
ecletica-1352	60	16	.	.	PUNCT
ecletica-1352	61	1	the	the	DET
ecletica-1352	61	2	nbo	nbo	PROPN
ecletica-1352	61	3	calculations	calculation	NOUN
ecletica-1352	61	4	were	be	AUX
ecletica-1352	61	5	conducted	conduct	VERB
ecletica-1352	61	6	using	use	VERB
ecletica-1352	61	7	nbo	nbo	PROPN
ecletica-1352	61	8	3.1	3.1	NUM
ecletica-1352	61	9	module	module	NOUN
ecletica-1352	61	10	embedded	embed	VERB
ecletica-1352	61	11	in	in	ADP
ecletica-1352	61	12	gaussian09w	gaussian09w	PROPN
ecletica-1352	61	13	(	(	PUNCT
ecletica-1352	61	14	bassey	bassey	NOUN
ecletica-1352	61	15	et	et	PROPN
ecletica-1352	61	16	al	al	PROPN
ecletica-1352	61	17	.	.	PROPN
ecletica-1352	61	18	,	,	PUNCT
ecletica-1352	61	19	2022	2022	NUM
ecletica-1352	61	20	)	)	PUNCT
ecletica-1352	61	21	.	.	PUNCT
ecletica-1352	62	1	highest	high	ADJ
ecletica-1352	62	2	occupied	occupy	VERB
ecletica-1352	62	3	and	and	CCONJ
ecletica-1352	62	4	lowest	low	ADJ
ecletica-1352	62	5	unoccupied	unoccupied	ADJ
ecletica-1352	62	6	molecular	molecular	ADJ
ecletica-1352	62	7	orbital	orbital	ADJ
ecletica-1352	62	8	(	(	PUNCT
ecletica-1352	62	9	homo	homo	NOUN
ecletica-1352	62	10	and	and	CCONJ
ecletica-1352	62	11	lumo	lumo	NOUN
ecletica-1352	62	12	)	)	PUNCT
ecletica-1352	62	13	isosurface	isosurface	NOUN
ecletica-1352	62	14	maps	map	NOUN
ecletica-1352	62	15	were	be	AUX
ecletica-1352	62	16	plotted	plot	VERB
ecletica-1352	62	17	using	use	VERB
ecletica-1352	62	18	multiwfn	multiwfn	PROPN
ecletica-1352	62	19	3.7	3.7	NUM
ecletica-1352	62	20	dev	dev	NOUN
ecletica-1352	62	21	software	software	NOUN
ecletica-1352	62	22	(	(	PUNCT
ecletica-1352	62	23	isravel	isravel	NOUN
ecletica-1352	62	24	et	et	NOUN
ecletica-1352	62	25	al	al	PROPN
ecletica-1352	62	26	.	.	PROPN
ecletica-1352	62	27	,	,	PUNCT
ecletica-1352	62	28	2021	2021	NUM
ecletica-1352	62	29	)	)	PUNCT
ecletica-1352	62	30	.	.	PUNCT
ecletica-1352	63	1	origin	origin	NOUN
ecletica-1352	63	2	8.0	8.0	NUM
ecletica-1352	63	3	pro	pro	NOUN
ecletica-1352	63	4	was	be	AUX
ecletica-1352	63	5	used	use	VERB
ecletica-1352	63	6	for	for	ADP
ecletica-1352	63	7	charge	charge	NOUN
ecletica-1352	63	8	analysis	analysis	NOUN
ecletica-1352	63	9	.	.	PUNCT
ecletica-1352	64	1	for	for	ADP
ecletica-1352	64	2	molecular	molecular	ADJ
ecletica-1352	64	3	docking	docking	NOUN
ecletica-1352	64	4	simulation	simulation	NOUN
ecletica-1352	64	5	,	,	PUNCT
ecletica-1352	64	6	3d	3d	NUM
ecletica-1352	64	7	structures	structure	NOUN
ecletica-1352	64	8	of	of	ADP
ecletica-1352	64	9	the	the	DET
ecletica-1352	64	10	protein	protein	NOUN
ecletica-1352	64	11	complex	complex	NOUN
ecletica-1352	64	12	(	(	PUNCT
ecletica-1352	64	13	pdb	pdb	PROPN
ecletica-1352	64	14	code	code	PROPN
ecletica-1352	64	15	:	:	PUNCT
ecletica-1352	64	16	1d7u	1d7u	NUM
ecletica-1352	64	17	and	and	CCONJ
ecletica-1352	64	18	2xcs	2xcs	NUM
ecletica-1352	64	19	)	)	PUNCT
ecletica-1352	64	20	were	be	AUX
ecletica-1352	64	21	gotten	get	VERB
ecletica-1352	64	22	from	from	ADP
ecletica-1352	64	23	the	the	DET
ecletica-1352	64	24	research	research	NOUN
ecletica-1352	64	25	collaboratory	collaboratory	NOUN
ecletica-1352	64	26	for	for	ADP
ecletica-1352	64	27	structural	structural	ADJ
ecletica-1352	64	28	bioinformatics	bioinformatics	NOUN
ecletica-1352	64	29	(	(	PUNCT
ecletica-1352	64	30	rcsb	rcsb	NOUN
ecletica-1352	64	31	)	)	PUNCT
ecletica-1352	64	32	website	website	NOUN
ecletica-1352	64	33	(	(	PUNCT
ecletica-1352	64	34	deshpande	deshpande	PROPN
ecletica-1352	64	35	et	et	PROPN
ecletica-1352	64	36	al	al	PROPN
ecletica-1352	64	37	.	.	PROPN
ecletica-1352	64	38	,	,	PUNCT
ecletica-1352	64	39	2005	2005	NUM
ecletica-1352	64	40	)	)	PUNCT
ecletica-1352	64	41	.	.	PUNCT
ecletica-1352	65	1	the	the	DET
ecletica-1352	65	2	proteins	protein	NOUN
ecletica-1352	65	3	were	be	AUX
ecletica-1352	65	4	prepared	prepare	VERB
ecletica-1352	65	5	using	use	VERB
ecletica-1352	65	6	the	the	DET
ecletica-1352	65	7	biovia	biovia	PROPN
ecletica-1352	65	8	discovery	discovery	PROPN
ecletica-1352	65	9	studio	studio	PROPN
ecletica-1352	65	10	4.5	4.5	NUM
ecletica-1352	65	11	software	software	NOUN
ecletica-1352	65	12	and	and	CCONJ
ecletica-1352	65	13	docking	docking	NOUN
ecletica-1352	65	14	was	be	AUX
ecletica-1352	65	15	then	then	ADV
ecletica-1352	65	16	performed	perform	VERB
ecletica-1352	65	17	using	use	VERB
ecletica-1352	65	18	autodock	autodock	PROPN
ecletica-1352	65	19	vina	vina	PROPN
ecletica-1352	65	20	(	(	PUNCT
ecletica-1352	65	21	berman	berman	PROPN
ecletica-1352	65	22	et	et	PROPN
ecletica-1352	65	23	al	al	PROPN
ecletica-1352	65	24	.	.	PROPN
ecletica-1352	65	25	,	,	PUNCT
ecletica-1352	65	26	2002	2002	NUM
ecletica-1352	65	27	;	;	PUNCT
ecletica-1352	65	28	trott	trott	PROPN
ecletica-1352	65	29	and	and	CCONJ
ecletica-1352	65	30	olson	olson	NOUN
ecletica-1352	65	31	,	,	PUNCT
ecletica-1352	65	32	2010	2010	NUM
ecletica-1352	65	33	)	)	PUNCT
ecletica-1352	65	34	.	.	PUNCT
ecletica-1352	66	1	the	the	DET
ecletica-1352	66	2	3d	3d	PROPN
ecletica-1352	66	3	and	and	CCONJ
ecletica-1352	66	4	2d	2d	NUM
ecletica-1352	66	5	metal	metal	NOUN
ecletica-1352	66	6	-	-	PUNCT
ecletica-1352	66	7	ligand	ligand	NOUN
ecletica-1352	66	8	interaction	interaction	NOUN
ecletica-1352	66	9	as	as	ADV
ecletica-1352	66	10	well	well	ADV
ecletica-1352	66	11	as	as	ADP
ecletica-1352	66	12	the	the	DET
ecletica-1352	66	13	h	h	NOUN
ecletica-1352	66	14	-	-	PUNCT
ecletica-1352	66	15	bond	bond	NOUN
ecletica-1352	66	16	interaction	interaction	NOUN
ecletica-1352	66	17	was	be	AUX
ecletica-1352	66	18	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	NOUN
ecletica-1352	66	19	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	ADJ
ecletica-1352	66	20	original	original	ADJ
ecletica-1352	66	21	article	article	NOUN
ecletica-1352	66	22	revista.iq.unesp.br	revista.iq.unesp.br	ADJ
ecletica-1352	66	23	40	40	NUM
ecletica-1352	66	24	eclética	eclética	PROPN
ecletica-1352	66	25	química	química	PROPN
ecletica-1352	66	26	journal	journal	PROPN
ecletica-1352	66	27	,	,	PUNCT
ecletica-1352	66	28	vol	vol	NOUN
ecletica-1352	66	29	.	.	PROPN
ecletica-1352	67	1	47	47	NUM
ecletica-1352	67	2	,	,	PUNCT
ecletica-1352	67	3	n.	n.	NOUN
ecletica-1352	67	4	4	4	NUM
ecletica-1352	67	5	,	,	PUNCT
ecletica-1352	67	6	2022	2022	NUM
ecletica-1352	67	7	,	,	PUNCT
ecletica-1352	67	8	37	37	NUM
ecletica-1352	67	9	-	-	SYM
ecletica-1352	67	10	50	50	NUM
ecletica-1352	67	11	issn	issn	NOUN
ecletica-1352	67	12	:	:	PUNCT
ecletica-1352	67	13	1678	1678	NUM
ecletica-1352	67	14	-	-	SYM
ecletica-1352	67	15	4618	4618	NUM
ecletica-1352	67	16	doi	doi	NOUN
ecletica-1352	67	17	:	:	PUNCT
ecletica-1352	67	18	10.26850/1678	10.26850/1678	NUM
ecletica-1352	67	19	-	-	PUNCT
ecletica-1352	67	20	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	67	21	-	-	PUNCT
ecletica-1352	67	22	50	50	NUM
ecletica-1352	67	23	visualized	visualize	VERB
ecletica-1352	67	24	using	use	VERB
ecletica-1352	67	25	the	the	DET
ecletica-1352	67	26	biovia	biovia	PROPN
ecletica-1352	67	27	discovery	discovery	PROPN
ecletica-1352	67	28	studio	studio	NOUN
ecletica-1352	67	29	presented	present	VERB
ecletica-1352	67	30	in	in	ADP
ecletica-1352	67	31	supplementary	supplementary	ADJ
ecletica-1352	67	32	information	information	NOUN
ecletica-1352	67	33	meanwhile	meanwhile	ADV
ecletica-1352	67	34	the	the	DET
ecletica-1352	67	35	cadmium	cadmium	NOUN
ecletica-1352	67	36	ligand	ligand	NOUN
ecletica-1352	67	37	and	and	CCONJ
ecletica-1352	67	38	the	the	DET
ecletica-1352	67	39	standard	standard	ADJ
ecletica-1352	67	40	drug	drug	NOUN
ecletica-1352	67	41	levofloxacin	levofloxacin	NOUN
ecletica-1352	67	42	docked	dock	VERB
ecletica-1352	67	43	with	with	ADP
ecletica-1352	67	44	the	the	DET
ecletica-1352	67	45	receptor	receptor	NOUN
ecletica-1352	67	46	protein	protein	NOUN
ecletica-1352	67	47	were	be	AUX
ecletica-1352	67	48	visualized	visualize	VERB
ecletica-1352	67	49	using	use	VERB
ecletica-1352	67	50	pymol	pymol	NOUN
ecletica-1352	67	51	(	(	PUNCT
ecletica-1352	67	52	seeliger	seeliger	NOUN
ecletica-1352	67	53	and	and	CCONJ
ecletica-1352	67	54	groot	groot	NOUN
ecletica-1352	67	55	,	,	PUNCT
ecletica-1352	67	56	2010	2010	NUM
ecletica-1352	67	57	)	)	PUNCT
ecletica-1352	67	58	.	.	PUNCT
ecletica-1352	68	1	swissadme	swissadme	NOUN
ecletica-1352	68	2	and	and	CCONJ
ecletica-1352	68	3	pkcsm	pkcsm	NOUN
ecletica-1352	68	4	was	be	AUX
ecletica-1352	68	5	used	use	VERB
ecletica-1352	68	6	for	for	ADP
ecletica-1352	68	7	the	the	DET
ecletica-1352	68	8	in	in	ADP
ecletica-1352	68	9	-	-	PUNCT
ecletica-1352	68	10	silico	silico	NOUN
ecletica-1352	68	11	admet	admet	NOUN
ecletica-1352	68	12	studies	study	NOUN
ecletica-1352	68	13	(	(	PUNCT
ecletica-1352	68	14	kiran	kiran	PROPN
ecletica-1352	68	15	et	et	PROPN
ecletica-1352	68	16	al	al	PROPN
ecletica-1352	68	17	.	.	PROPN
ecletica-1352	68	18	,	,	PUNCT
ecletica-1352	68	19	2020	2020	NUM
ecletica-1352	68	20	;	;	PUNCT
ecletica-1352	68	21	sharbidre	sharbidre	PROPN
ecletica-1352	68	22	et	et	PROPN
ecletica-1352	68	23	al	al	PROPN
ecletica-1352	68	24	.	.	PROPN
ecletica-1352	68	25	,	,	PUNCT
ecletica-1352	68	26	2021	2021	NUM
ecletica-1352	68	27	)	)	PUNCT
ecletica-1352	68	28	.	.	PUNCT
ecletica-1352	69	1	3	3	X
ecletica-1352	69	2	.	.	NOUN
ecletica-1352	69	3	results	result	NOUN
ecletica-1352	69	4	and	and	CCONJ
ecletica-1352	69	5	discussion	discussion	NOUN
ecletica-1352	69	6	3.1	3.1	NUM
ecletica-1352	69	7	structural	structural	ADJ
ecletica-1352	69	8	parameters	parameter	NOUN
ecletica-1352	69	9	the	the	DET
ecletica-1352	69	10	molecular	molecular	ADJ
ecletica-1352	69	11	structure	structure	NOUN
ecletica-1352	69	12	as	as	SCONJ
ecletica-1352	69	13	revealed	reveal	VERB
ecletica-1352	69	14	by	by	ADP
ecletica-1352	69	15	single	single	ADJ
ecletica-1352	69	16	crystal	crystal	NOUN
ecletica-1352	69	17	x	x	PROPN
ecletica-1352	69	18	-	-	NOUN
ecletica-1352	69	19	ray	ray	NOUN
ecletica-1352	69	20	diffraction	diffraction	NOUN
ecletica-1352	69	21	(	(	PUNCT
ecletica-1352	69	22	scxrd	scxrd	NOUN
ecletica-1352	69	23	)	)	PUNCT
ecletica-1352	69	24	technique	technique	NOUN
ecletica-1352	69	25	shows	show	VERB
ecletica-1352	69	26	that	that	SCONJ
ecletica-1352	69	27	the	the	DET
ecletica-1352	69	28	cd(ii	cd(ii	PROPN
ecletica-1352	69	29	)	)	PUNCT
ecletica-1352	69	30	ion	ion	NOUN
ecletica-1352	69	31	is	be	AUX
ecletica-1352	69	32	surrounded	surround	VERB
ecletica-1352	69	33	by	by	ADP
ecletica-1352	69	34	seven	seven	NUM
ecletica-1352	69	35	oxygen	oxygen	NOUN
ecletica-1352	69	36	atoms	atom	NOUN
ecletica-1352	69	37	.	.	PUNCT
ecletica-1352	70	1	two	two	NUM
ecletica-1352	70	2	of	of	ADP
ecletica-1352	70	3	the	the	DET
ecletica-1352	70	4	oxygen	oxygen	NOUN
ecletica-1352	70	5	atoms	atom	NOUN
ecletica-1352	70	6	(	(	PUNCT
ecletica-1352	70	7	o1w	o1w	X
ecletica-1352	70	8	and	and	CCONJ
ecletica-1352	70	9	o2w	o2w	NUM
ecletica-1352	70	10	)	)	PUNCT
ecletica-1352	70	11	are	be	AUX
ecletica-1352	70	12	from	from	ADP
ecletica-1352	70	13	two	two	NUM
ecletica-1352	70	14	coordinated	coordinate	VERB
ecletica-1352	70	15	water	water	NOUN
ecletica-1352	70	16	molecules	molecule	NOUN
ecletica-1352	70	17	.	.	PUNCT
ecletica-1352	71	1	the	the	DET
ecletica-1352	71	2	ortep	ortep	NOUN
ecletica-1352	71	3	drawing	drawing	NOUN
ecletica-1352	71	4	of	of	ADP
ecletica-1352	71	5	[	[	X
ecletica-1352	71	6	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	71	7	showing	show	VERB
ecletica-1352	71	8	the	the	DET
ecletica-1352	71	9	coordination	coordination	NOUN
ecletica-1352	71	10	environment	environment	NOUN
ecletica-1352	71	11	of	of	ADP
ecletica-1352	71	12	the	the	DET
ecletica-1352	71	13	cd(ii	cd(ii	NOUN
ecletica-1352	71	14	)	)	PUNCT
ecletica-1352	71	15	ion	ion	NOUN
ecletica-1352	71	16	can	can	AUX
ecletica-1352	71	17	be	be	AUX
ecletica-1352	71	18	seen	see	VERB
ecletica-1352	71	19	in	in	ADP
ecletica-1352	71	20	fig	fig	NOUN
ecletica-1352	71	21	.	.	PUNCT
ecletica-1352	72	1	1	1	X
ecletica-1352	72	2	.	.	X
ecletica-1352	72	3	bond	bond	NOUN
ecletica-1352	72	4	lengths	length	NOUN
ecletica-1352	72	5	of	of	ADP
ecletica-1352	72	6	cd	cd	PROPN
ecletica-1352	72	7	–	–	PUNCT
ecletica-1352	72	8	o1w	o1w	PROPN
ecletica-1352	72	9	and	and	CCONJ
ecletica-1352	72	10	cd	cd	PROPN
ecletica-1352	72	11	–	–	PUNCT
ecletica-1352	72	12	o2w	o2w	NUM
ecletica-1352	72	13	are	be	AUX
ecletica-1352	72	14	2.305	2.305	NUM
ecletica-1352	72	15	and	and	CCONJ
ecletica-1352	72	16	2.380	2.380	NUM
ecletica-1352	72	17	å	å	NOUN
ecletica-1352	72	18	respectively	respectively	ADV
ecletica-1352	72	19	,	,	PUNCT
ecletica-1352	72	20	and	and	CCONJ
ecletica-1352	72	21	are	be	AUX
ecletica-1352	72	22	slightly	slightly	ADV
ecletica-1352	72	23	similar	similar	ADJ
ecletica-1352	72	24	to	to	ADP
ecletica-1352	72	25	the	the	DET
ecletica-1352	72	26	bond	bond	NOUN
ecletica-1352	72	27	lengths	length	NOUN
ecletica-1352	72	28	of	of	ADP
ecletica-1352	72	29	cd	cd	PROPN
ecletica-1352	72	30	–	–	PUNCT
ecletica-1352	72	31	o1w	o1w	X
ecletica-1352	72	32	(	(	PUNCT
ecletica-1352	72	33	2.285	2.285	NUM
ecletica-1352	72	34	ẳ	ẳ	NOUN
ecletica-1352	72	35	)	)	PUNCT
ecletica-1352	72	36	and	and	CCONJ
ecletica-1352	72	37	cd	cd	PROPN
ecletica-1352	72	38	–	–	PUNCT
ecletica-1352	72	39	o2w	o2w	PROPN
ecletica-1352	72	40	(	(	PUNCT
ecletica-1352	72	41	2.555	2.555	NUM
ecletica-1352	72	42	å	å	NOUN
ecletica-1352	72	43	)	)	PUNCT
ecletica-1352	72	44	reported	report	VERB
ecletica-1352	72	45	by	by	ADP
ecletica-1352	72	46	louis	louis	PROPN
ecletica-1352	72	47	et	et	PROPN
ecletica-1352	72	48	al	al	PROPN
ecletica-1352	72	49	.	.	PROPN
ecletica-1352	72	50	,	,	PUNCT
ecletica-1352	72	51	(	(	PUNCT
ecletica-1352	72	52	2022	2022	NUM
ecletica-1352	72	53	)	)	PUNCT
ecletica-1352	72	54	.	.	PUNCT
ecletica-1352	73	1	the	the	DET
ecletica-1352	73	2	other	other	ADJ
ecletica-1352	73	3	five	five	NUM
ecletica-1352	73	4	oxygen	oxygen	NOUN
ecletica-1352	73	5	atoms	atom	NOUN
ecletica-1352	73	6	are	be	AUX
ecletica-1352	73	7	coordinated	coordinate	VERB
ecletica-1352	73	8	from	from	ADP
ecletica-1352	73	9	three	three	NUM
ecletica-1352	73	10	btc	btc	ADJ
ecletica-1352	73	11	ligands	ligand	NOUN
ecletica-1352	73	12	.	.	PUNCT
ecletica-1352	74	1	two	two	NUM
ecletica-1352	74	2	of	of	ADP
ecletica-1352	74	3	the	the	DET
ecletica-1352	74	4	btc	btc	ADJ
ecletica-1352	74	5	molecules	molecule	NOUN
ecletica-1352	74	6	are	be	AUX
ecletica-1352	74	7	bonded	bond	VERB
ecletica-1352	74	8	through	through	ADP
ecletica-1352	74	9	(	(	PUNCT
ecletica-1352	74	10	o3	o3	PROPN
ecletica-1352	74	11	,	,	PUNCT
ecletica-1352	74	12	o4	o4	PROPN
ecletica-1352	74	13	,	,	PUNCT
ecletica-1352	74	14	o5	o5	PROPN
ecletica-1352	74	15	,	,	PUNCT
ecletica-1352	74	16	and	and	CCONJ
ecletica-1352	74	17	o6	o6	ADJ
ecletica-1352	74	18	)	)	PUNCT
ecletica-1352	74	19	oxygen	oxygen	NOUN
ecletica-1352	74	20	atoms	atom	NOUN
ecletica-1352	74	21	of	of	ADP
ecletica-1352	74	22	the	the	DET
ecletica-1352	74	23	carboxylate	carboxylate	NOUN
ecletica-1352	74	24	group	group	NOUN
ecletica-1352	74	25	in	in	ADP
ecletica-1352	74	26	a	a	DET
ecletica-1352	74	27	bidentate	bidentate	ADJ
ecletica-1352	74	28	chelating	chelating	NOUN
ecletica-1352	74	29	fashion	fashion	NOUN
ecletica-1352	74	30	while	while	SCONJ
ecletica-1352	74	31	the	the	DET
ecletica-1352	74	32	third	third	ADJ
ecletica-1352	74	33	btc	btc	PROPN
ecletica-1352	74	34	ligand	ligand	NOUN
ecletica-1352	74	35	coordinates	coordinate	NOUN
ecletica-1352	74	36	to	to	ADP
ecletica-1352	74	37	the	the	DET
ecletica-1352	74	38	cd(ii	cd(ii	NOUN
ecletica-1352	74	39	)	)	PUNCT
ecletica-1352	74	40	ion	ion	NOUN
ecletica-1352	74	41	in	in	ADP
ecletica-1352	74	42	a	a	DET
ecletica-1352	74	43	monodentate	monodentate	ADJ
ecletica-1352	74	44	manner	manner	NOUN
ecletica-1352	74	45	by	by	ADP
ecletica-1352	74	46	the	the	DET
ecletica-1352	74	47	carboxylic	carboxylic	ADJ
ecletica-1352	74	48	carbonyl	carbonyl	NOUN
ecletica-1352	74	49	oxygen	oxygen	NOUN
ecletica-1352	74	50	(	(	PUNCT
ecletica-1352	74	51	o7	o7	ADJ
ecletica-1352	74	52	)	)	PUNCT
ecletica-1352	74	53	atom	atom	NOUN
ecletica-1352	74	54	.	.	PUNCT
ecletica-1352	75	1	the	the	DET
ecletica-1352	75	2	cd	cd	PROPN
ecletica-1352	75	3	–	–	PUNCT
ecletica-1352	75	4	o	o	NOUN
ecletica-1352	75	5	bond	bond	NOUN
ecletica-1352	75	6	lengths	length	NOUN
ecletica-1352	75	7	vary	vary	VERB
ecletica-1352	75	8	in	in	ADP
ecletica-1352	75	9	the	the	DET
ecletica-1352	75	10	range	range	NOUN
ecletica-1352	75	11	2.291(3)–2.567(3	2.291(3)–2.567(3	NUM
ecletica-1352	75	12	)	)	PUNCT
ecletica-1352	75	13	å	å	PROPN
ecletica-1352	75	14	(	(	PUNCT
ecletica-1352	75	15	fig	fig	NOUN
ecletica-1352	75	16	.	.	NOUN
ecletica-1352	75	17	1	1	NUM
ecletica-1352	75	18	and	and	CCONJ
ecletica-1352	75	19	tabs	tab	NOUN
ecletica-1352	75	20	.	.	PUNCT
ecletica-1352	75	21	2	2	NUM
ecletica-1352	75	22	and	and	CCONJ
ecletica-1352	75	23	3	3	NUM
ecletica-1352	75	24	)	)	PUNCT
ecletica-1352	75	25	.	.	PUNCT
ecletica-1352	76	1	figure	figure	NOUN
ecletica-1352	76	2	1	1	NUM
ecletica-1352	76	3	.	.	PUNCT
ecletica-1352	77	1	the	the	DET
ecletica-1352	77	2	ortep	ortep	NOUN
ecletica-1352	77	3	drawing	drawing	NOUN
ecletica-1352	77	4	of	of	ADP
ecletica-1352	77	5	[	[	X
ecletica-1352	77	6	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	77	7	showing	show	VERB
ecletica-1352	77	8	the	the	DET
ecletica-1352	77	9	coordination	coordination	NOUN
ecletica-1352	77	10	environment	environment	NOUN
ecletica-1352	77	11	of	of	ADP
ecletica-1352	77	12	the	the	DET
ecletica-1352	77	13	cd(ii	cd(ii	NOUN
ecletica-1352	77	14	)	)	PUNCT
ecletica-1352	77	15	ion	ion	NOUN
ecletica-1352	77	16	.	.	PUNCT
ecletica-1352	78	1	the	the	DET
ecletica-1352	78	2	btc	btc	ADJ
ecletica-1352	78	3	ligands	ligand	NOUN
ecletica-1352	78	4	with	with	ADP
ecletica-1352	78	5	µ3	µ3	NUM
ecletica-1352	78	6	coordination	coordination	NOUN
ecletica-1352	78	7	mode	mode	NOUN
ecletica-1352	78	8	bridged	bridge	VERB
ecletica-1352	78	9	three	three	NUM
ecletica-1352	78	10	adjacent	adjacent	ADJ
ecletica-1352	78	11	cd	cd	PROPN
ecletica-1352	78	12	(	(	PUNCT
ecletica-1352	78	13	ii	ii	NOUN
ecletica-1352	78	14	)	)	PUNCT
ecletica-1352	78	15	ions	ion	NOUN
ecletica-1352	78	16	to	to	PART
ecletica-1352	78	17	form	form	VERB
ecletica-1352	78	18	a	a	DET
ecletica-1352	78	19	two	two	NUM
ecletica-1352	78	20	-	-	PUNCT
ecletica-1352	78	21	dimensional	dimensional	ADJ
ecletica-1352	78	22	sheet	sheet	NOUN
ecletica-1352	78	23	structure	structure	NOUN
ecletica-1352	78	24	which	which	PRON
ecletica-1352	78	25	in	in	ADP
ecletica-1352	78	26	turn	turn	NOUN
ecletica-1352	78	27	as	as	ADP
ecletica-1352	78	28	a	a	DET
ecletica-1352	78	29	result	result	NOUN
ecletica-1352	78	30	of	of	ADP
ecletica-1352	78	31	the	the	DET
ecletica-1352	78	32	hydrogen	hydrogen	NOUN
ecletica-1352	78	33	bonding	bonding	NOUN
ecletica-1352	78	34	(	(	PUNCT
ecletica-1352	78	35	o	o	NOUN
ecletica-1352	78	36	–	–	PUNCT
ecletica-1352	78	37	h	h	NOUN
ecletica-1352	78	38	…	…	PUNCT
ecletica-1352	78	39	…	…	SYM
ecletica-1352	78	40	o	o	NOUN
ecletica-1352	78	41	)	)	PUNCT
ecletica-1352	78	42	interaction	interaction	NOUN
ecletica-1352	78	43	from	from	ADP
ecletica-1352	78	44	the	the	DET
ecletica-1352	78	45	coordinated	coordinate	VERB
ecletica-1352	78	46	water	water	NOUN
ecletica-1352	78	47	molecules	molecule	NOUN
ecletica-1352	78	48	(	(	PUNCT
ecletica-1352	78	49	o1w	o1w	X
ecletica-1352	78	50	and	and	CCONJ
ecletica-1352	78	51	o2w	o2w	NUM
ecletica-1352	78	52	)	)	PUNCT
ecletica-1352	78	53	and	and	CCONJ
ecletica-1352	78	54	the	the	DET
ecletica-1352	78	55	protonated	protonate	VERB
ecletica-1352	78	56	carboxyl	carboxyl	NOUN
ecletica-1352	78	57	group	group	NOUN
ecletica-1352	78	58	of	of	ADP
ecletica-1352	78	59	one	one	NUM
ecletica-1352	78	60	of	of	ADP
ecletica-1352	78	61	the	the	DET
ecletica-1352	78	62	ligands	ligand	NOUN
ecletica-1352	78	63	branched	branch	VERB
ecletica-1352	78	64	into	into	ADP
ecletica-1352	78	65	a	a	DET
ecletica-1352	78	66	three	three	NUM
ecletica-1352	78	67	-	-	PUNCT
ecletica-1352	78	68	dimensional	dimensional	ADJ
ecletica-1352	78	69	network	network	NOUN
ecletica-1352	78	70	of	of	ADP
ecletica-1352	78	71	supramolecular	supramolecular	ADJ
ecletica-1352	78	72	structure	structure	NOUN
ecletica-1352	78	73	.	.	PUNCT
ecletica-1352	79	1	3.2	3.2	NUM
ecletica-1352	79	2	reactivity	reactivity	NOUN
ecletica-1352	79	3	parameters	parameter	NOUN
ecletica-1352	79	4	the	the	DET
ecletica-1352	79	5	frontier	frontier	NOUN
ecletica-1352	79	6	molecular	molecular	ADJ
ecletica-1352	79	7	orbital	orbital	NOUN
ecletica-1352	79	8	which	which	PRON
ecletica-1352	79	9	comprises	comprise	VERB
ecletica-1352	79	10	of	of	ADP
ecletica-1352	79	11	the	the	DET
ecletica-1352	79	12	highest	high	ADJ
ecletica-1352	79	13	occupied	occupy	VERB
ecletica-1352	79	14	molecular	molecular	ADJ
ecletica-1352	79	15	orbital	orbital	ADJ
ecletica-1352	79	16	(	(	PUNCT
ecletica-1352	79	17	homo	homo	NOUN
ecletica-1352	79	18	)	)	PUNCT
ecletica-1352	79	19	and	and	CCONJ
ecletica-1352	79	20	the	the	DET
ecletica-1352	79	21	lowest	low	ADJ
ecletica-1352	79	22	unoccupied	unoccupied	ADJ
ecletica-1352	79	23	molecular	molecular	ADJ
ecletica-1352	79	24	orbital	orbital	ADJ
ecletica-1352	79	25	(	(	PUNCT
ecletica-1352	79	26	lumo	lumo	NOUN
ecletica-1352	79	27	)	)	PUNCT
ecletica-1352	79	28	are	be	AUX
ecletica-1352	79	29	important	important	ADJ
ecletica-1352	79	30	parameters	parameter	NOUN
ecletica-1352	79	31	when	when	SCONJ
ecletica-1352	79	32	considering	consider	VERB
ecletica-1352	79	33	the	the	DET
ecletica-1352	79	34	stability	stability	NOUN
ecletica-1352	79	35	and	and	CCONJ
ecletica-1352	79	36	chemical	chemical	NOUN
ecletica-1352	79	37	reactivity	reactivity	NOUN
ecletica-1352	79	38	of	of	ADP
ecletica-1352	79	39	a	a	DET
ecletica-1352	79	40	complex	complex	NOUN
ecletica-1352	79	41	(	(	PUNCT
ecletica-1352	79	42	agwupuye	agwupuye	PROPN
ecletica-1352	79	43	et	et	PROPN
ecletica-1352	79	44	al	al	PROPN
ecletica-1352	79	45	.	.	PROPN
ecletica-1352	79	46	,	,	PUNCT
ecletica-1352	79	47	2021a	2021a	NUM
ecletica-1352	79	48	;	;	PUNCT
ecletica-1352	79	49	2021b	2021b	NUM
ecletica-1352	79	50	)	)	PUNCT
ecletica-1352	79	51	.	.	PUNCT
ecletica-1352	80	1	the	the	DET
ecletica-1352	80	2	energy	energy	NOUN
ecletica-1352	80	3	gap	gap	NOUN
ecletica-1352	80	4	is	be	AUX
ecletica-1352	80	5	the	the	DET
ecletica-1352	80	6	difference	difference	NOUN
ecletica-1352	80	7	in	in	ADP
ecletica-1352	80	8	energy	energy	NOUN
ecletica-1352	80	9	between	between	ADP
ecletica-1352	80	10	the	the	DET
ecletica-1352	80	11	homo	homo	NOUN
ecletica-1352	80	12	and	and	CCONJ
ecletica-1352	80	13	lumo	lumo	NOUN
ecletica-1352	80	14	orbitals	orbital	NOUN
ecletica-1352	80	15	.	.	PUNCT
ecletica-1352	81	1	interestingly	interestingly	ADV
ecletica-1352	81	2	,	,	PUNCT
ecletica-1352	81	3	the	the	DET
ecletica-1352	81	4	energy	energy	NOUN
ecletica-1352	81	5	gap	gap	NOUN
ecletica-1352	81	6	is	be	AUX
ecletica-1352	81	7	a	a	DET
ecletica-1352	81	8	critical	critical	ADJ
ecletica-1352	81	9	parameter	parameter	NOUN
ecletica-1352	81	10	in	in	ADP
ecletica-1352	81	11	describing	describe	VERB
ecletica-1352	81	12	a	a	DET
ecletica-1352	81	13	molecule	molecule	NOUN
ecletica-1352	81	14	's	's	PART
ecletica-1352	81	15	reactivity	reactivity	NOUN
ecletica-1352	81	16	and	and	CCONJ
ecletica-1352	81	17	stability	stability	NOUN
ecletica-1352	81	18	(	(	PUNCT
ecletica-1352	81	19	izuchukwu	izuchukwu	PROPN
ecletica-1352	81	20	et	et	PROPN
ecletica-1352	81	21	al	al	PROPN
ecletica-1352	81	22	.	.	PROPN
ecletica-1352	81	23	,	,	PUNCT
ecletica-1352	81	24	2022	2022	NUM
ecletica-1352	81	25	)	)	PUNCT
ecletica-1352	81	26	.	.	PUNCT
ecletica-1352	82	1	the	the	DET
ecletica-1352	82	2	homo	homo	NOUN
ecletica-1352	82	3	and	and	CCONJ
ecletica-1352	82	4	lumo	lumo	NOUN
ecletica-1352	82	5	values	value	NOUN
ecletica-1352	82	6	are	be	AUX
ecletica-1352	82	7	also	also	ADV
ecletica-1352	82	8	useful	useful	ADJ
ecletica-1352	82	9	when	when	SCONJ
ecletica-1352	82	10	calculating	calculate	VERB
ecletica-1352	82	11	the	the	DET
ecletica-1352	82	12	global	global	ADJ
ecletica-1352	82	13	quantum	quantum	NOUN
ecletica-1352	82	14	descriptors	descriptor	NOUN
ecletica-1352	82	15	,	,	PUNCT
ecletica-1352	82	16	which	which	PRON
ecletica-1352	82	17	further	far	ADV
ecletica-1352	82	18	explain	explain	VERB
ecletica-1352	82	19	a	a	DET
ecletica-1352	82	20	molecule	molecule	NOUN
ecletica-1352	82	21	's	's	PART
ecletica-1352	82	22	stability	stability	NOUN
ecletica-1352	82	23	.	.	PUNCT
ecletica-1352	83	1	the	the	DET
ecletica-1352	83	2	energy	energy	NOUN
ecletica-1352	83	3	gap	gap	NOUN
ecletica-1352	83	4	,	,	PUNCT
ecletica-1352	83	5	as	as	ADV
ecletica-1352	83	6	well	well	ADV
ecletica-1352	83	7	as	as	ADP
ecletica-1352	83	8	quantum	quantum	NOUN
ecletica-1352	83	9	descriptors	descriptor	NOUN
ecletica-1352	83	10	such	such	ADJ
ecletica-1352	83	11	as	as	ADP
ecletica-1352	83	12	chemical	chemical	NOUN
ecletica-1352	83	13	potential	potential	NOUN
ecletica-1352	83	14	,	,	PUNCT
ecletica-1352	83	15	chemical	chemical	ADJ
ecletica-1352	83	16	hardness	hardness	NOUN
ecletica-1352	83	17	,	,	PUNCT
ecletica-1352	83	18	chemical	chemical	NOUN
ecletica-1352	83	19	softness	softness	NOUN
ecletica-1352	83	20	,	,	PUNCT
ecletica-1352	83	21	and	and	CCONJ
ecletica-1352	83	22	electrophilicity	electrophilicity	NOUN
ecletica-1352	83	23	,	,	PUNCT
ecletica-1352	83	24	are	be	AUX
ecletica-1352	83	25	calculated	calculate	VERB
ecletica-1352	83	26	and	and	CCONJ
ecletica-1352	83	27	presented	present	VERB
ecletica-1352	83	28	in	in	ADP
ecletica-1352	83	29	tab	tab	NOUN
ecletica-1352	83	30	.	.	PUNCT
ecletica-1352	84	1	4	4	NUM
ecletica-1352	84	2	(	(	PUNCT
ecletica-1352	84	3	udoikono	udoikono	PROPN
ecletica-1352	84	4	et	et	PROPN
ecletica-1352	84	5	al	al	PROPN
ecletica-1352	84	6	.	.	PROPN
ecletica-1352	84	7	,	,	PUNCT
ecletica-1352	84	8	2022	2022	NUM
ecletica-1352	84	9	;	;	PUNCT
ecletica-1352	84	10	wu	wu	PROPN
ecletica-1352	84	11	et	et	PROPN
ecletica-1352	84	12	al	al	PROPN
ecletica-1352	84	13	.	.	PROPN
ecletica-1352	84	14	,	,	PUNCT
ecletica-1352	84	15	2012	2012	NUM
ecletica-1352	84	16	)	)	PUNCT
ecletica-1352	84	17	.	.	PUNCT
ecletica-1352	85	1	the	the	DET
ecletica-1352	85	2	low	low	ADJ
ecletica-1352	85	3	energy	energy	NOUN
ecletica-1352	85	4	gap	gap	NOUN
ecletica-1352	85	5	indicates	indicate	VERB
ecletica-1352	85	6	higher	high	ADJ
ecletica-1352	85	7	chemical	chemical	NOUN
ecletica-1352	85	8	reactivity	reactivity	NOUN
ecletica-1352	85	9	,	,	PUNCT
ecletica-1352	85	10	polarizability	polarizability	NOUN
ecletica-1352	85	11	,	,	PUNCT
ecletica-1352	85	12	and	and	CCONJ
ecletica-1352	85	13	low	low	ADJ
ecletica-1352	85	14	kinetic	kinetic	ADJ
ecletica-1352	85	15	stability	stability	NOUN
ecletica-1352	85	16	(	(	PUNCT
ecletica-1352	85	17	unimuke	unimuke	NOUN
ecletica-1352	85	18	et	et	PROPN
ecletica-1352	85	19	al	al	PROPN
ecletica-1352	85	20	.	.	PROPN
ecletica-1352	85	21	,	,	PUNCT
ecletica-1352	85	22	2022	2022	NUM
ecletica-1352	85	23	)	)	PUNCT
ecletica-1352	85	24	.	.	PUNCT
ecletica-1352	86	1	this	this	PRON
ecletica-1352	86	2	explains	explain	VERB
ecletica-1352	86	3	the	the	DET
ecletica-1352	86	4	intramolecular	intramolecular	ADJ
ecletica-1352	86	5	charge	charge	NOUN
ecletica-1352	86	6	transfer	transfer	NOUN
ecletica-1352	86	7	within	within	ADP
ecletica-1352	86	8	the	the	DET
ecletica-1352	86	9	complex	complex	NOUN
ecletica-1352	86	10	and	and	CCONJ
ecletica-1352	86	11	describes	describe	VERB
ecletica-1352	86	12	the	the	DET
ecletica-1352	86	13	bioactivity	bioactivity	NOUN
ecletica-1352	86	14	of	of	ADP
ecletica-1352	86	15	the	the	DET
ecletica-1352	86	16	compound	compound	NOUN
ecletica-1352	86	17	.	.	PUNCT
ecletica-1352	87	1	moreover	moreover	ADV
ecletica-1352	87	2	,	,	PUNCT
ecletica-1352	87	3	the	the	DET
ecletica-1352	87	4	chemical	chemical	NOUN
ecletica-1352	87	5	potential	potential	NOUN
ecletica-1352	87	6	is	be	AUX
ecletica-1352	87	7	the	the	DET
ecletica-1352	87	8	negative	negative	ADJ
ecletica-1352	87	9	of	of	ADP
ecletica-1352	87	10	electronegativity	electronegativity	NOUN
ecletica-1352	87	11	(	(	PUNCT
ecletica-1352	87	12	eno	eno	PROPN
ecletica-1352	87	13	et	et	PROPN
ecletica-1352	87	14	al	al	PROPN
ecletica-1352	87	15	.	.	PROPN
ecletica-1352	87	16	,	,	PUNCT
ecletica-1352	87	17	2022	2022	NUM
ecletica-1352	87	18	;	;	PUNCT
ecletica-1352	87	19	kavimani	kavimani	PROPN
ecletica-1352	87	20	et	et	PROPN
ecletica-1352	87	21	al	al	PROPN
ecletica-1352	87	22	.	.	PROPN
ecletica-1352	87	23	,	,	PUNCT
ecletica-1352	87	24	2018	2018	NUM
ecletica-1352	87	25	)	)	PUNCT
ecletica-1352	87	26	.	.	PUNCT
ecletica-1352	88	1	from	from	ADP
ecletica-1352	88	2	our	our	PRON
ecletica-1352	88	3	result	result	NOUN
ecletica-1352	88	4	,	,	PUNCT
ecletica-1352	88	5	the	the	DET
ecletica-1352	88	6	cd	cd	PROPN
ecletica-1352	88	7	complex	complex	NOUN
ecletica-1352	88	8	has	have	VERB
ecletica-1352	88	9	a	a	DET
ecletica-1352	88	10	low	low	ADJ
ecletica-1352	88	11	chemical	chemical	ADJ
ecletica-1352	88	12	potential	potential	ADJ
ecletica-1352	88	13	value	value	NOUN
ecletica-1352	88	14	of	of	ADP
ecletica-1352	88	15	–	–	PUNCT
ecletica-1352	88	16	6.23	6.23	NUM
ecletica-1352	88	17	ev	ev	NOUN
ecletica-1352	88	18	.	.	PUNCT
ecletica-1352	89	1	this	this	PRON
ecletica-1352	89	2	is	be	AUX
ecletica-1352	89	3	because	because	SCONJ
ecletica-1352	89	4	the	the	DET
ecletica-1352	89	5	electrons	electron	NOUN
ecletica-1352	89	6	in	in	ADP
ecletica-1352	89	7	the	the	DET
ecletica-1352	89	8	fermi	fermi	NOUN
ecletica-1352	89	9	energy	energy	NOUN
ecletica-1352	89	10	level	level	NOUN
ecletica-1352	89	11	regions	region	NOUN
ecletica-1352	89	12	are	be	AUX
ecletica-1352	89	13	loosely	loosely	ADV
ecletica-1352	89	14	bound	bind	VERB
ecletica-1352	89	15	.	.	PUNCT
ecletica-1352	90	1	this	this	PRON
ecletica-1352	90	2	is	be	AUX
ecletica-1352	90	3	an	an	DET
ecletica-1352	90	4	indication	indication	NOUN
ecletica-1352	90	5	that	that	SCONJ
ecletica-1352	90	6	the	the	DET
ecletica-1352	90	7	complex	complex	NOUN
ecletica-1352	90	8	has	have	AUX
ecletica-1352	90	9	greater	great	ADJ
ecletica-1352	90	10	ability	ability	NOUN
ecletica-1352	90	11	to	to	PART
ecletica-1352	90	12	accept	accept	VERB
ecletica-1352	90	13	electrons	electron	NOUN
ecletica-1352	90	14	.	.	PUNCT
ecletica-1352	91	1	the	the	DET
ecletica-1352	91	2	small	small	ADJ
ecletica-1352	91	3	energy	energy	NOUN
ecletica-1352	91	4	gap	gap	NOUN
ecletica-1352	91	5	(	(	PUNCT
ecletica-1352	91	6	0.3322	0.3322	NUM
ecletica-1352	91	7	ev	ev	PRON
ecletica-1352	91	8	)	)	PUNCT
ecletica-1352	91	9	indicates	indicate	VERB
ecletica-1352	91	10	possible	possible	ADJ
ecletica-1352	91	11	excitation	excitation	NOUN
ecletica-1352	91	12	of	of	ADP
ecletica-1352	91	13	electrons	electron	NOUN
ecletica-1352	91	14	from	from	ADP
ecletica-1352	91	15	homo	homo	NOUN
ecletica-1352	91	16	to	to	ADP
ecletica-1352	91	17	lumo	lumo	NOUN
ecletica-1352	91	18	hence	hence	ADV
ecletica-1352	91	19	low	low	ADJ
ecletica-1352	91	20	stability	stability	NOUN
ecletica-1352	91	21	of	of	ADP
ecletica-1352	91	22	the	the	DET
ecletica-1352	91	23	complex	complex	NOUN
ecletica-1352	91	24	.	.	PUNCT
ecletica-1352	92	1	the	the	DET
ecletica-1352	92	2	chemical	chemical	ADJ
ecletica-1352	92	3	hardness	hardness	NOUN
ecletica-1352	92	4	value	value	NOUN
ecletica-1352	92	5	of	of	ADP
ecletica-1352	92	6	0.16	0.16	NUM
ecletica-1352	92	7	ev	ev	INTJ
ecletica-1352	92	8	indicates	indicate	VERB
ecletica-1352	92	9	a	a	DET
ecletica-1352	92	10	soft	soft	ADJ
ecletica-1352	92	11	molecule	molecule	NOUN
ecletica-1352	92	12	and	and	CCONJ
ecletica-1352	92	13	this	this	PRON
ecletica-1352	92	14	corresponds	correspond	VERB
ecletica-1352	92	15	with	with	ADP
ecletica-1352	92	16	the	the	DET
ecletica-1352	92	17	softness	softness	ADJ
ecletica-1352	92	18	value	value	NOUN
ecletica-1352	92	19	of	of	ADP
ecletica-1352	92	20	6.02	6.02	NUM
ecletica-1352	92	21	ev	ev	NOUN
ecletica-1352	92	22	as	as	ADP
ecletica-1352	92	23	softness	softness	NOUN
ecletica-1352	92	24	is	be	AUX
ecletica-1352	92	25	inversely	inversely	ADV
ecletica-1352	92	26	proportional	proportional	ADJ
ecletica-1352	92	27	to	to	ADP
ecletica-1352	92	28	hardness	hardness	NOUN
ecletica-1352	92	29	(	(	PUNCT
ecletica-1352	92	30	gber	gber	PROPN
ecletica-1352	92	31	et	et	PROPN
ecletica-1352	92	32	al	al	PROPN
ecletica-1352	92	33	.	.	PROPN
ecletica-1352	92	34	,	,	PUNCT
ecletica-1352	92	35	2022	2022	NUM
ecletica-1352	92	36	)	)	PUNCT
ecletica-1352	92	37	.	.	PUNCT
ecletica-1352	93	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	93	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	93	3	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	PROPN
ecletica-1352	93	4	original	original	ADJ
ecletica-1352	93	5	article	article	NOUN
ecletica-1352	93	6	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	93	7	41	41	NUM
ecletica-1352	93	8	eclética	eclética	PROPN
ecletica-1352	93	9	química	química	PROPN
ecletica-1352	93	10	journal	journal	PROPN
ecletica-1352	93	11	,	,	PUNCT
ecletica-1352	93	12	vol	vol	NOUN
ecletica-1352	93	13	.	.	PROPN
ecletica-1352	93	14	47	47	NUM
ecletica-1352	93	15	,	,	PUNCT
ecletica-1352	93	16	n.	n.	NOUN
ecletica-1352	93	17	4	4	NUM
ecletica-1352	93	18	,	,	PUNCT
ecletica-1352	93	19	2022	2022	NUM
ecletica-1352	93	20	,	,	PUNCT
ecletica-1352	93	21	37	37	NUM
ecletica-1352	93	22	-	-	SYM
ecletica-1352	93	23	50	50	NUM
ecletica-1352	93	24	issn	issn	NOUN
ecletica-1352	93	25	:	:	PUNCT
ecletica-1352	93	26	1678	1678	NUM
ecletica-1352	93	27	-	-	SYM
ecletica-1352	93	28	4618	4618	NUM
ecletica-1352	93	29	doi	doi	NOUN
ecletica-1352	93	30	:	:	PUNCT
ecletica-1352	93	31	10.26850/1678	10.26850/1678	NUM
ecletica-1352	93	32	-	-	PUNCT
ecletica-1352	93	33	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	ADJ
ecletica-1352	93	34	-	-	PUNCT
ecletica-1352	93	35	50	50	NUM
ecletica-1352	93	36	table	table	NOUN
ecletica-1352	93	37	2	2	NUM
ecletica-1352	93	38	.	.	NUM
ecletica-1352	93	39	selected	select	VERB
ecletica-1352	93	40	bond	bond	NOUN
ecletica-1352	93	41	lengths	length	NOUN
ecletica-1352	93	42	(	(	PUNCT
ecletica-1352	93	43	å	å	NOUN
ecletica-1352	93	44	)	)	PUNCT
ecletica-1352	93	45	.	.	PUNCT
ecletica-1352	94	1	atom	atom	NOUN
ecletica-1352	94	2	set	set	VERB
ecletica-1352	94	3	length	length	NOUN
ecletica-1352	94	4	(	(	PUNCT
ecletica-1352	94	5	å	å	NOUN
ecletica-1352	94	6	)	)	PUNCT
ecletica-1352	94	7	atom	atom	NOUN
ecletica-1352	94	8	set	set	VERB
ecletica-1352	94	9	length	length	NOUN
ecletica-1352	94	10	(	(	PUNCT
ecletica-1352	94	11	å	å	NOUN
ecletica-1352	94	12	)	)	PUNCT
ecletica-1352	94	13	cd1	cd1	PROPN
ecletica-1352	94	14	o1	o1	PROPN
ecletica-1352	94	15	2.305(3	2.305(3	NUM
ecletica-1352	94	16	)	)	PUNCT
ecletica-1352	94	17	o7	o7	PROPN
ecletica-1352	94	18	c9	c9	NOUN
ecletica-1352	94	19	1.228(5	1.228(5	NUM
ecletica-1352	94	20	)	)	PUNCT
ecletica-1352	94	21	cd1	cd1	NOUN
ecletica-1352	94	22	o2	o2	PROPN
ecletica-1352	94	23	2.380(3	2.380(3	NUM
ecletica-1352	94	24	)	)	PUNCT
ecletica-1352	94	25	o8	o8	NOUN
ecletica-1352	94	26	c9	c9	NOUN
ecletica-1352	94	27	1.312(5	1.312(5	NUM
ecletica-1352	94	28	)	)	PUNCT
ecletica-1352	94	29	cd1	cd1	PROPN
ecletica-1352	94	30	o3	o3	PROPN
ecletica-1352	94	31	2.537(3	2.537(3	PROPN
ecletica-1352	94	32	)	)	PUNCT
ecletica-1352	94	33	c1	c1	PROPN
ecletica-1352	94	34	c2	c2	PROPN
ecletica-1352	94	35	1.496(5	1.496(5	NUM
ecletica-1352	94	36	)	)	PUNCT
ecletica-1352	94	37	cd1	cd1	NOUN
ecletica-1352	94	38	o4	o4	PROPN
ecletica-1352	94	39	2.239(3	2.239(3	NUM
ecletica-1352	94	40	)	)	PUNCT
ecletica-1352	94	41	c2	c2	PROPN
ecletica-1352	94	42	c3	c3	PROPN
ecletica-1352	94	43	1.397(5	1.397(5	NUM
ecletica-1352	94	44	)	)	PUNCT
ecletica-1352	94	45	cd1	cd1	VERB
ecletica-1352	94	46	o51	o51	NOUN
ecletica-1352	94	47	2.278(2	2.278(2	NUM
ecletica-1352	94	48	)	)	PUNCT
ecletica-1352	94	49	c2	c2	PROPN
ecletica-1352	94	50	c7	c7	PROPN
ecletica-1352	94	51	1.400(5	1.400(5	NUM
ecletica-1352	94	52	)	)	PUNCT
ecletica-1352	94	53	cd1	cd1	NOUN
ecletica-1352	94	54	o61	o61	PROPN
ecletica-1352	94	55	2.567(3	2.567(3	NUM
ecletica-1352	94	56	)	)	PUNCT
ecletica-1352	94	57	c3	c3	PROPN
ecletica-1352	94	58	c4	c4	PROPN
ecletica-1352	94	59	1.393(5	1.393(5	NUM
ecletica-1352	94	60	)	)	PUNCT
ecletica-1352	94	61	table	table	NOUN
ecletica-1352	94	62	3	3	NUM
ecletica-1352	94	63	.	.	PUNCT
ecletica-1352	94	64	selected	select	VERB
ecletica-1352	94	65	bond	bond	NOUN
ecletica-1352	94	66	angles	angle	NOUN
ecletica-1352	94	67	(	(	PUNCT
ecletica-1352	94	68	˚	˚	PROPN
ecletica-1352	94	69	)	)	PUNCT
ecletica-1352	94	70	.	.	PUNCT
ecletica-1352	95	1	atom	atom	NOUN
ecletica-1352	95	2	set	set	VERB
ecletica-1352	95	3	angle	angle	NOUN
ecletica-1352	95	4	(	(	PUNCT
ecletica-1352	95	5	˚	˚	PROPN
ecletica-1352	95	6	)	)	PUNCT
ecletica-1352	95	7	atom	atom	NOUN
ecletica-1352	95	8	set	set	VERB
ecletica-1352	95	9	angle	angle	NOUN
ecletica-1352	95	10	(	(	PUNCT
ecletica-1352	95	11	˚	˚	PROPN
ecletica-1352	95	12	)	)	PUNCT
ecletica-1352	95	13	o1	o1	PROPN
ecletica-1352	95	14	cd1	cd1	NOUN
ecletica-1352	95	15	o2	o2	PROPN
ecletica-1352	95	16	175.92(9	175.92(9	NUM
ecletica-1352	95	17	)	)	PUNCT
ecletica-1352	95	18	c1	c1	NOUN
ecletica-1352	95	19	o4	o4	PROPN
ecletica-1352	95	20	cd1	cd1	PROPN
ecletica-1352	95	21	98.4(2	98.4(2	PROPN
ecletica-1352	95	22	)	)	PUNCT
ecletica-1352	95	23	o1	o1	PROPN
ecletica-1352	95	24	cd1	cd1	PROPN
ecletica-1352	95	25	o3	o3	PROPN
ecletica-1352	95	26	88.31(10	88.31(10	NUM
ecletica-1352	95	27	)	)	PUNCT
ecletica-1352	95	28	c8	c8	PROPN
ecletica-1352	95	29	o5	o5	PROPN
ecletica-1352	95	30	cd13	cd13	PROPN
ecletica-1352	95	31	99.0(2	99.0(2	PROPN
ecletica-1352	95	32	)	)	PUNCT
ecletica-1352	95	33	o1	o1	NOUN
ecletica-1352	95	34	cd1	cd1	NOUN
ecletica-1352	95	35	o61	o61	PROPN
ecletica-1352	95	36	84.45(9	84.45(9	NUM
ecletica-1352	95	37	)	)	PUNCT
ecletica-1352	95	38	c8	c8	PROPN
ecletica-1352	95	39	o6	o6	PROPN
ecletica-1352	95	40	cd13	cd13	PROPN
ecletica-1352	95	41	86.1(2	86.1(2	PROPN
ecletica-1352	95	42	)	)	PUNCT
ecletica-1352	95	43	o1	o1	PROPN
ecletica-1352	95	44	cd1	cd1	PROPN
ecletica-1352	95	45	c1	c1	PROPN
ecletica-1352	95	46	88.37(10	88.37(10	PROPN
ecletica-1352	95	47	)	)	PUNCT
ecletica-1352	95	48	c9	c9	NOUN
ecletica-1352	95	49	o7	o7	PROPN
ecletica-1352	95	50	cd14	cd14	PROPN
ecletica-1352	95	51	136.6(2	136.6(2	NUM
ecletica-1352	95	52	)	)	PUNCT
ecletica-1352	95	53	o2	o2	PROPN
ecletica-1352	95	54	cd1	cd1	PROPN
ecletica-1352	95	55	o3	o3	PROPN
ecletica-1352	95	56	93.34(10	93.34(10	NUM
ecletica-1352	95	57	)	)	PUNCT
ecletica-1352	95	58	o3	o3	PROPN
ecletica-1352	95	59	c1	c1	PROPN
ecletica-1352	95	60	cd1	cd1	PROPN
ecletica-1352	95	61	67.5(2	67.5(2	PROPN
ecletica-1352	95	62	)	)	PUNCT
ecletica-1352	95	63	o2	o2	PROPN
ecletica-1352	95	64	cd1	cd1	PROPN
ecletica-1352	95	65	o61	o61	PROPN
ecletica-1352	95	66	92.14(9	92.14(9	PROPN
ecletica-1352	95	67	)	)	PUNCT
ecletica-1352	95	68	o3	o3	PROPN
ecletica-1352	95	69	c1	c1	PROPN
ecletica-1352	95	70	o4	o4	VERB
ecletica-1352	95	71	121.5(3	121.5(3	NUM
ecletica-1352	95	72	)	)	PUNCT
ecletica-1352	95	73	o2	o2	PROPN
ecletica-1352	95	74	cd1	cd1	PROPN
ecletica-1352	95	75	c1	c1	PROPN
ecletica-1352	95	76	91.38(10	91.38(10	NUM
ecletica-1352	95	77	)	)	PUNCT
ecletica-1352	95	78	o3	o3	PROPN
ecletica-1352	95	79	c1	c1	PROPN
ecletica-1352	95	80	c2	c2	PROPN
ecletica-1352	95	81	121.0(3	121.0(3	NUM
ecletica-1352	95	82	)	)	PUNCT
ecletica-1352	96	1	o3	o3	PROPN
ecletica-1352	96	2	cd1	cd1	PROPN
ecletica-1352	96	3	o61	o61	PROPN
ecletica-1352	96	4	146.55(9	146.55(9	NUM
ecletica-1352	96	5	)	)	PUNCT
ecletica-1352	97	1	o4	o4	PROPN
ecletica-1352	97	2	c1	c1	PROPN
ecletica-1352	97	3	cd1	cd1	PROPN
ecletica-1352	97	4	54.03(18	54.03(18	NUM
ecletica-1352	97	5	)	)	PUNCT
ecletica-1352	97	6	o3	o3	PROPN
ecletica-1352	97	7	cd1	cd1	PROPN
ecletica-1352	97	8	c1	c1	PROPN
ecletica-1352	97	9	27.18(10	27.18(10	NUM
ecletica-1352	97	10	)	)	PUNCT
ecletica-1352	97	11	o4	o4	PROPN
ecletica-1352	97	12	c1	c1	PROPN
ecletica-1352	97	13	c2	c2	PROPN
ecletica-1352	97	14	117.5(3	117.5(3	NUM
ecletica-1352	97	15	)	)	PUNCT
ecletica-1352	98	1	o4	o4	PROPN
ecletica-1352	98	2	cd1	cd1	PROPN
ecletica-1352	98	3	o1	o1	PROPN
ecletica-1352	98	4	89.30(10	89.30(10	NUM
ecletica-1352	98	5	)	)	PUNCT
ecletica-1352	98	6	c2	c2	PROPN
ecletica-1352	98	7	c1	c1	PROPN
ecletica-1352	98	8	cd1	cd1	PROPN
ecletica-1352	98	9	171.4(3	171.4(3	NUM
ecletica-1352	98	10	)	)	PUNCT
ecletica-1352	98	11	o4	o4	PROPN
ecletica-1352	98	12	cd1	cd1	PROPN
ecletica-1352	98	13	o2	o2	PROPN
ecletica-1352	98	14	88.60(10	88.60(10	NUM
ecletica-1352	98	15	)	)	PUNCT
ecletica-1352	98	16	c3	c3	PROPN
ecletica-1352	98	17	c2	c2	PROPN
ecletica-1352	98	18	c1	c1	PROPN
ecletica-1352	98	19	119.8(3	119.8(3	PROPN
ecletica-1352	98	20	)	)	PUNCT
ecletica-1352	99	1	o4	o4	PROPN
ecletica-1352	99	2	cd1	cd1	PROPN
ecletica-1352	99	3	o3	o3	PROPN
ecletica-1352	99	4	54.71(10	54.71(10	NUM
ecletica-1352	99	5	)	)	PUNCT
ecletica-1352	99	6	c3	c3	PROPN
ecletica-1352	99	7	c2	c2	PROPN
ecletica-1352	99	8	c7	c7	PROPN
ecletica-1352	99	9	119.3(3	119.3(3	NUM
ecletica-1352	99	10	)	)	PUNCT
ecletica-1352	99	11	table	table	NOUN
ecletica-1352	99	12	4	4	NUM
ecletica-1352	99	13	.	.	PUNCT
ecletica-1352	99	14	homo	homo	NOUN
ecletica-1352	99	15	/	/	SYM
ecletica-1352	99	16	lumo	lumo	NOUN
ecletica-1352	99	17	,	,	PUNCT
ecletica-1352	99	18	energy	energy	NOUN
ecletica-1352	99	19	gap	gap	NOUN
ecletica-1352	99	20	and	and	CCONJ
ecletica-1352	99	21	the	the	DET
ecletica-1352	99	22	quantum	quantum	ADJ
ecletica-1352	99	23	chemical	chemical	NOUN
ecletica-1352	99	24	reactivity	reactivity	NOUN
ecletica-1352	99	25	parameters	parameter	NOUN
ecletica-1352	99	26	.	.	PUNCT
ecletica-1352	100	1	chemical	chemical	NOUN
ecletica-1352	100	2	parameters	parameter	NOUN
ecletica-1352	100	3	charge	charge	VERB
ecletica-1352	100	4	(	(	PUNCT
ecletica-1352	100	5	ev	ev	NOUN
ecletica-1352	100	6	)	)	PUNCT
ecletica-1352	100	7	chemical	chemical	NOUN
ecletica-1352	100	8	potential	potential	NOUN
ecletica-1352	100	9	(	(	PUNCT
ecletica-1352	100	10	µ	µ	NOUN
ecletica-1352	100	11	)	)	PUNCT
ecletica-1352	100	12	–	–	PUNCT
ecletica-1352	100	13	6.23	6.23	NUM
ecletica-1352	100	14	hardness	hardness	NOUN
ecletica-1352	100	15	(	(	PUNCT
ecletica-1352	100	16	ƞ	ƞ	NOUN
ecletica-1352	100	17	)	)	PUNCT
ecletica-1352	100	18	0.16	0.16	NUM
ecletica-1352	100	19	homo	homo	NOUN
ecletica-1352	100	20	–	–	PUNCT
ecletica-1352	100	21	2	2	NUM
ecletica-1352	100	22	–	–	SYM
ecletica-1352	100	23	6.46	6.46	NUM
ecletica-1352	100	24	homo	homo	NOUN
ecletica-1352	100	25	–	–	PUNCT
ecletica-1352	100	26	1	1	NUM
ecletica-1352	100	27	–	–	SYM
ecletica-1352	100	28	6.42	6.42	NUM
ecletica-1352	100	29	homo	homo	NOUN
ecletica-1352	100	30	–	–	PUNCT
ecletica-1352	100	31	6.40	6.40	NUM
ecletica-1352	100	32	ionization	ionization	NOUN
ecletica-1352	100	33	potential	potential	NOUN
ecletica-1352	100	34	(	(	PUNCT
ecletica-1352	100	35	ip	ip	NOUN
ecletica-1352	100	36	)	)	PUNCT
ecletica-1352	100	37	6.40	6.40	NUM
ecletica-1352	100	38	electron	electron	NOUN
ecletica-1352	100	39	affinity	affinity	NOUN
ecletica-1352	100	40	(	(	PUNCT
ecletica-1352	100	41	ea	ea	NOUN
ecletica-1352	100	42	)	)	PUNCT
ecletica-1352	100	43	6.07	6.07	NUM
ecletica-1352	100	44	lumo	lumo	NOUN
ecletica-1352	100	45	–	–	PUNCT
ecletica-1352	100	46	6.07	6.07	NUM
ecletica-1352	100	47	lumo	lumo	NOUN
ecletica-1352	100	48	+	+	CCONJ
ecletica-1352	100	49	1	1	NUM
ecletica-1352	100	50	–	–	SYM
ecletica-1352	100	51	5.91	5.91	NUM
ecletica-1352	100	52	lumo	lumo	NOUN
ecletica-1352	100	53	+	+	CCONJ
ecletica-1352	100	54	2	2	NUM
ecletica-1352	100	55	–	–	SYM
ecletica-1352	100	56	1.99	1.99	NUM
ecletica-1352	100	57	energy	energy	NOUN
ecletica-1352	100	58	gap	gap	NOUN
ecletica-1352	100	59	eg	eg	NOUN
ecletica-1352	100	60	0.33	0.33	NUM
ecletica-1352	100	61	energy	energy	NOUN
ecletica-1352	100	62	gap	gap	NOUN
ecletica-1352	100	63	eg	eg	NOUN
ecletica-1352	100	64	1	1	NUM
ecletica-1352	100	65	0.51	0.51	NUM
ecletica-1352	100	66	energy	energy	NOUN
ecletica-1352	100	67	gap	gap	NOUN
ecletica-1352	100	68	eg	eg	ADP
ecletica-1352	100	69	2	2	NUM
ecletica-1352	100	70	4.47	4.47	NUM
ecletica-1352	100	71	electrophilicity	electrophilicity	NOUN
ecletica-1352	100	72	index	index	NOUN
ecletica-1352	100	73	(	(	PUNCT
ecletica-1352	100	74	ω	ω	NOUN
ecletica-1352	100	75	)	)	PUNCT
ecletica-1352	100	76	121.29	121.29	NUM
ecletica-1352	100	77	electronegativity	electronegativity	NOUN
ecletica-1352	100	78	(	(	PUNCT
ecletica-1352	100	79	χ	χ	NOUN
ecletica-1352	100	80	)	)	PUNCT
ecletica-1352	100	81	6.23	6.23	NUM
ecletica-1352	100	82	chemical	chemical	NOUN
ecletica-1352	100	83	softness	softness	NOUN
ecletica-1352	100	84	(	(	PUNCT
ecletica-1352	100	85	ѕ	ѕ	NOUN
ecletica-1352	100	86	)	)	PUNCT
ecletica-1352	100	87	6.02	6.02	NUM
ecletica-1352	100	88	source	source	NOUN
ecletica-1352	100	89	:	:	PUNCT
ecletica-1352	100	90	elaborated	elaborate	VERB
ecletica-1352	100	91	by	by	ADP
ecletica-1352	100	92	the	the	DET
ecletica-1352	100	93	authors	author	NOUN
ecletica-1352	100	94	using	use	VERB
ecletica-1352	100	95	data	datum	NOUN
ecletica-1352	100	96	from	from	ADP
ecletica-1352	100	97	bisong	bisong	ADP
ecletica-1352	100	98	et	et	PROPN
ecletica-1352	100	99	al	al	PROPN
ecletica-1352	100	100	.	.	PROPN
ecletica-1352	100	101	(	(	PUNCT
ecletica-1352	100	102	2020	2020	NUM
ecletica-1352	100	103	)	)	PUNCT
ecletica-1352	100	104	.	.	PUNCT
ecletica-1352	101	1	from	from	ADP
ecletica-1352	101	2	fig	fig	NOUN
ecletica-1352	101	3	.	.	PUNCT
ecletica-1352	102	1	2	2	NUM
ecletica-1352	102	2	,	,	PUNCT
ecletica-1352	102	3	it	it	PRON
ecletica-1352	102	4	is	be	AUX
ecletica-1352	102	5	evident	evident	ADJ
ecletica-1352	102	6	that	that	SCONJ
ecletica-1352	102	7	electron	electron	NOUN
ecletica-1352	102	8	distribution	distribution	NOUN
ecletica-1352	102	9	in	in	ADP
ecletica-1352	102	10	the	the	DET
ecletica-1352	102	11	homo	homo	NOUN
ecletica-1352	102	12	is	be	AUX
ecletica-1352	102	13	only	only	ADV
ecletica-1352	102	14	centred	centre	VERB
ecletica-1352	102	15	on	on	ADP
ecletica-1352	102	16	a	a	DET
ecletica-1352	102	17	relative	relative	ADJ
ecletica-1352	102	18	part	part	NOUN
ecletica-1352	102	19	of	of	ADP
ecletica-1352	102	20	the	the	DET
ecletica-1352	102	21	cd	cd	PROPN
ecletica-1352	102	22	atom	atom	NOUN
ecletica-1352	102	23	of	of	ADP
ecletica-1352	102	24	the	the	DET
ecletica-1352	102	25	mof	mof	NOUN
ecletica-1352	102	26	whereas	whereas	SCONJ
ecletica-1352	102	27	in	in	ADP
ecletica-1352	102	28	the	the	DET
ecletica-1352	102	29	lumo	lumo	NOUN
ecletica-1352	102	30	electrons	electron	NOUN
ecletica-1352	102	31	are	be	AUX
ecletica-1352	102	32	evenly	evenly	ADV
ecletica-1352	102	33	distributed	distribute	VERB
ecletica-1352	102	34	among	among	ADP
ecletica-1352	102	35	the	the	DET
ecletica-1352	102	36	cd	cd	PROPN
ecletica-1352	102	37	atom	atom	NOUN
ecletica-1352	102	38	of	of	ADP
ecletica-1352	102	39	the	the	DET
ecletica-1352	102	40	mof	mof	ADJ
ecletica-1352	102	41	complex	complex	NOUN
ecletica-1352	102	42	and	and	CCONJ
ecletica-1352	102	43	clouded	cloud	VERB
ecletica-1352	102	44	with	with	ADP
ecletica-1352	102	45	some	some	DET
ecletica-1352	102	46	percentage	percentage	NOUN
ecletica-1352	102	47	of	of	ADP
ecletica-1352	102	48	charge	charge	NOUN
ecletica-1352	102	49	delocalization	delocalization	NOUN
ecletica-1352	102	50	.	.	PUNCT
ecletica-1352	103	1	3.3	3.3	NUM
ecletica-1352	103	2	nbo	nbo	NOUN
ecletica-1352	103	3	analysis	analysis	NOUN
ecletica-1352	103	4	from	from	ADP
ecletica-1352	103	5	the	the	DET
ecletica-1352	103	6	output	output	NOUN
ecletica-1352	103	7	of	of	ADP
ecletica-1352	103	8	the	the	DET
ecletica-1352	103	9	nbo	nbo	PROPN
ecletica-1352	103	10	analysis	analysis	NOUN
ecletica-1352	103	11	,	,	PUNCT
ecletica-1352	103	12	the	the	DET
ecletica-1352	103	13	total	total	ADJ
ecletica-1352	103	14	lewis	lewis	PROPN
ecletica-1352	103	15	structure	structure	NOUN
ecletica-1352	103	16	has	have	VERB
ecletica-1352	103	17	97.330	97.330	NUM
ecletica-1352	103	18	%	%	NOUN
ecletica-1352	103	19	(	(	PUNCT
ecletica-1352	103	20	core	core	NOUN
ecletica-1352	103	21	:	:	PUNCT
ecletica-1352	103	22	99.996	99.996	NUM
ecletica-1352	103	23	%	%	NOUN
ecletica-1352	103	24	;	;	PUNCT
ecletica-1352	103	25	valence	valence	NOUN
ecletica-1352	103	26	lewis	lewis	PROPN
ecletica-1352	103	27	:	:	PUNCT
ecletica-1352	103	28	95.997	95.997	NUM
ecletica-1352	103	29	%	%	NOUN
ecletica-1352	103	30	)	)	PUNCT
ecletica-1352	103	31	and	and	CCONJ
ecletica-1352	103	32	the	the	DET
ecletica-1352	103	33	non	non	ADJ
ecletica-1352	103	34	-	-	ADJ
ecletica-1352	103	35	lewis	lewis	ADJ
ecletica-1352	103	36	structure	structure	NOUN
ecletica-1352	103	37	has	have	VERB
ecletica-1352	103	38	2.670	2.670	NUM
ecletica-1352	103	39	%	%	NOUN
ecletica-1352	103	40	and	and	CCONJ
ecletica-1352	103	41	rydberg	rydberg	PROPN
ecletica-1352	103	42	non	non	PROPN
ecletica-1352	103	43	-	-	PROPN
ecletica-1352	103	44	lewis	lewis	ADJ
ecletica-1352	103	45	0	0	NUM
ecletica-1352	103	46	%	%	NOUN
ecletica-1352	103	47	.	.	PUNCT
ecletica-1352	104	1	the	the	DET
ecletica-1352	104	2	nbo	nbo	PROPN
ecletica-1352	104	3	result	result	NOUN
ecletica-1352	104	4	(	(	PUNCT
ecletica-1352	104	5	tab	tab	NOUN
ecletica-1352	104	6	.	.	NOUN
ecletica-1352	104	7	5	5	NUM
ecletica-1352	104	8	)	)	PUNCT
ecletica-1352	104	9	showed	show	VERB
ecletica-1352	104	10	that	that	SCONJ
ecletica-1352	104	11	the	the	DET
ecletica-1352	104	12	σ	σ	PROPN
ecletica-1352	104	13	(	(	PUNCT
ecletica-1352	104	14	cd1	cd1	PROPN
ecletica-1352	104	15	-	-	PUNCT
ecletica-1352	104	16	o3	o3	PROPN
ecletica-1352	104	17	)	)	PUNCT
ecletica-1352	104	18	bond	bond	NOUN
ecletica-1352	104	19	was	be	AUX
ecletica-1352	104	20	formed	form	VERB
ecletica-1352	104	21	from	from	ADP
ecletica-1352	104	22	the	the	DET
ecletica-1352	104	23	sp0.58	sp0.58	NOUN
ecletica-1352	104	24	hybrid	hybrid	NOUN
ecletica-1352	104	25	orbital	orbital	NOUN
ecletica-1352	104	26	on	on	ADP
ecletica-1352	104	27	cadmium	cadmium	NOUN
ecletica-1352	104	28	(	(	PUNCT
ecletica-1352	104	29	36.51	36.51	NUM
ecletica-1352	104	30	%	%	NOUN
ecletica-1352	104	31	p	p	NOUN
ecletica-1352	104	32	-	-	PUNCT
ecletica-1352	104	33	character	character	NOUN
ecletica-1352	104	34	)	)	PUNCT
ecletica-1352	104	35	interacting	interact	VERB
ecletica-1352	104	36	with	with	ADP
ecletica-1352	104	37	sp34.85	sp34.85	PROPN
ecletica-1352	104	38	hybrid	hybrid	ADJ
ecletica-1352	104	39	orbital	orbital	NOUN
ecletica-1352	104	40	on	on	ADP
ecletica-1352	104	41	oxygen	oxygen	NOUN
ecletica-1352	104	42	(	(	PUNCT
ecletica-1352	104	43	97.21	97.21	NUM
ecletica-1352	104	44	%	%	NOUN
ecletica-1352	104	45	p	p	NOUN
ecletica-1352	104	46	-	-	NOUN
ecletica-1352	104	47	character	character	NOUN
ecletica-1352	104	48	)	)	PUNCT
ecletica-1352	104	49	.	.	PUNCT
ecletica-1352	105	1	the	the	DET
ecletica-1352	105	2	sp2.84	sp2.84	PROPN
ecletica-1352	105	3	hybrid	hybrid	NOUN
ecletica-1352	105	4	on	on	ADP
ecletica-1352	105	5	carbon	carbon	NOUN
ecletica-1352	105	6	atom	atom	NOUN
ecletica-1352	105	7	(	(	PUNCT
ecletica-1352	105	8	73.98	73.98	NUM
ecletica-1352	105	9	%	%	NOUN
ecletica-1352	105	10	p	p	NOUN
ecletica-1352	105	11	-	-	PUNCT
ecletica-1352	105	12	character	character	NOUN
ecletica-1352	105	13	)	)	PUNCT
ecletica-1352	105	14	interacted	interact	VERB
ecletica-1352	105	15	with	with	ADP
ecletica-1352	105	16	sp2.33	sp2.33	NOUN
ecletica-1352	105	17	hybrid	hybrid	ADJ
ecletica-1352	105	18	atom	atom	NOUN
ecletica-1352	105	19	of	of	ADP
ecletica-1352	105	20	carbon	carbon	NOUN
ecletica-1352	105	21	(	(	PUNCT
ecletica-1352	105	22	70.01	70.01	NUM
ecletica-1352	105	23	%	%	NOUN
ecletica-1352	105	24	p	p	NOUN
ecletica-1352	105	25	-	-	NOUN
ecletica-1352	105	26	character	character	NOUN
ecletica-1352	105	27	)	)	PUNCT
ecletica-1352	105	28	in	in	ADP
ecletica-1352	105	29	sigma	sigma	PROPN
ecletica-1352	105	30	bond	bond	PROPN
ecletica-1352	105	31	(	(	PUNCT
ecletica-1352	105	32	c6	c6	PROPN
ecletica-1352	105	33	-	-	PUNCT
ecletica-1352	105	34	c8	c8	PROPN
ecletica-1352	105	35	)	)	PUNCT
ecletica-1352	105	36	.	.	PUNCT
ecletica-1352	106	1	also	also	ADV
ecletica-1352	106	2	,	,	PUNCT
ecletica-1352	106	3	the	the	DET
ecletica-1352	106	4	transition	transition	NOUN
ecletica-1352	106	5	between	between	ADP
ecletica-1352	106	6	σ	σ	PROPN
ecletica-1352	106	7	(	(	PUNCT
ecletica-1352	106	8	c6	c6	PROPN
ecletica-1352	106	9	-	-	PUNCT
ecletica-1352	106	10	h63	h63	PROPN
ecletica-1352	106	11	)	)	PUNCT
ecletica-1352	106	12	with	with	ADP
ecletica-1352	106	13	sp2.71	sp2.71	PROPN
ecletica-1352	106	14	hybrid	hybrid	ADJ
ecletica-1352	106	15	on	on	ADP
ecletica-1352	106	16	carbon	carbon	NOUN
ecletica-1352	106	17	(	(	PUNCT
ecletica-1352	106	18	73.02	73.02	NUM
ecletica-1352	106	19	%	%	NOUN
ecletica-1352	106	20	p	p	NOUN
ecletica-1352	106	21	-	-	NOUN
ecletica-1352	106	22	character	character	NOUN
ecletica-1352	106	23	)	)	PUNCT
ecletica-1352	106	24	and	and	CCONJ
ecletica-1352	106	25	on	on	ADP
ecletica-1352	106	26	hydrogen	hydrogen	NOUN
ecletica-1352	106	27	(	(	PUNCT
ecletica-1352	106	28	100	100	NUM
ecletica-1352	106	29	%	%	NOUN
ecletica-1352	106	30	scharacter	scharacter	ADJ
ecletica-1352	106	31	)	)	PUNCT
ecletica-1352	106	32	.	.	PUNCT
ecletica-1352	107	1	the	the	DET
ecletica-1352	107	2	sp1.90	sp1.90	NOUN
ecletica-1352	107	3	hybrid	hybrid	NOUN
ecletica-1352	107	4	on	on	ADP
ecletica-1352	107	5	carbon	carbon	NOUN
ecletica-1352	107	6	atom	atom	NOUN
ecletica-1352	107	7	(	(	PUNCT
ecletica-1352	107	8	65.53	65.53	NUM
ecletica-1352	107	9	%	%	NOUN
ecletica-1352	107	10	pcharacter	pcharacter	NOUN
ecletica-1352	107	11	)	)	PUNCT
ecletica-1352	107	12	interacted	interact	VERB
ecletica-1352	107	13	with	with	ADP
ecletica-1352	107	14	sp4.40	sp4.40	NOUN
ecletica-1352	107	15	hybrid	hybrid	ADJ
ecletica-1352	107	16	atom	atom	NOUN
ecletica-1352	107	17	of	of	ADP
ecletica-1352	107	18	carbon	carbon	NOUN
ecletica-1352	107	19	(	(	PUNCT
ecletica-1352	107	20	81.49	81.49	NUM
ecletica-1352	107	21	%	%	NOUN
ecletica-1352	107	22	p	p	NOUN
ecletica-1352	107	23	-	-	NOUN
ecletica-1352	107	24	character	character	NOUN
ecletica-1352	107	25	)	)	PUNCT
ecletica-1352	107	26	in	in	ADP
ecletica-1352	107	27	sigma	sigma	PROPN
ecletica-1352	107	28	bond	bond	PROPN
ecletica-1352	107	29	(	(	PUNCT
ecletica-1352	107	30	c6	c6	PROPN
ecletica-1352	107	31	-	-	PUNCT
ecletica-1352	107	32	c8	c8	PROPN
ecletica-1352	107	33	)	)	PUNCT
ecletica-1352	107	34	.	.	PUNCT
ecletica-1352	108	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	108	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	108	3	original	original	ADJ
ecletica-1352	108	4	article	article	NOUN
ecletica-1352	108	5	revista.iq.unesp.br	revista.iq.unesp.br	VERB
ecletica-1352	108	6	42	42	NUM
ecletica-1352	108	7	eclética	eclética	PROPN
ecletica-1352	108	8	química	química	PROPN
ecletica-1352	108	9	journal	journal	PROPN
ecletica-1352	108	10	,	,	PUNCT
ecletica-1352	108	11	vol	vol	NOUN
ecletica-1352	108	12	.	.	PROPN
ecletica-1352	108	13	47	47	NUM
ecletica-1352	108	14	,	,	PUNCT
ecletica-1352	108	15	n.	n.	NOUN
ecletica-1352	108	16	4	4	NUM
ecletica-1352	108	17	,	,	PUNCT
ecletica-1352	108	18	2022	2022	NUM
ecletica-1352	108	19	,	,	PUNCT
ecletica-1352	108	20	37	37	NUM
ecletica-1352	108	21	-	-	SYM
ecletica-1352	108	22	50	50	NUM
ecletica-1352	108	23	issn	issn	NOUN
ecletica-1352	108	24	:	:	PUNCT
ecletica-1352	108	25	1678	1678	NUM
ecletica-1352	108	26	-	-	SYM
ecletica-1352	108	27	4618	4618	NUM
ecletica-1352	108	28	doi	doi	NOUN
ecletica-1352	108	29	:	:	PUNCT
ecletica-1352	108	30	10.26850/1678	10.26850/1678	NUM
ecletica-1352	108	31	-	-	PUNCT
ecletica-1352	108	32	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	108	33	-	-	PUNCT
ecletica-1352	108	34	50	50	NUM
ecletica-1352	108	35	figure2	figure2	NOUN
ecletica-1352	108	36	.	.	PUNCT
ecletica-1352	109	1	pictorial	pictorial	ADJ
ecletica-1352	109	2	representation	representation	NOUN
ecletica-1352	109	3	of	of	ADP
ecletica-1352	109	4	the	the	DET
ecletica-1352	109	5	molecular	molecular	ADJ
ecletica-1352	109	6	properties	property	NOUN
ecletica-1352	109	7	.	.	PUNCT
ecletica-1352	110	1	table	table	NOUN
ecletica-1352	110	2	5	5	NUM
ecletica-1352	110	3	.	.	PUNCT
ecletica-1352	110	4	nbo	nbo	PROPN
ecletica-1352	110	5	analysis	analysis	NOUN
ecletica-1352	110	6	,	,	PUNCT
ecletica-1352	110	7	occupancies	occupancy	NOUN
ecletica-1352	110	8	,	,	PUNCT
ecletica-1352	110	9	hybrid	hybrid	NOUN
ecletica-1352	110	10	,	,	PUNCT
ecletica-1352	110	11	and	and	CCONJ
ecletica-1352	110	12	atomic	atomic	ADJ
ecletica-1352	110	13	orbitals	orbital	NOUN
ecletica-1352	110	14	of	of	ADP
ecletica-1352	110	15	the	the	DET
ecletica-1352	110	16	studied	studied	ADJ
ecletica-1352	110	17	complex	complex	ADJ
ecletica-1352	110	18	parameters	parameter	NOUN
ecletica-1352	110	19	occupancies	occupancy	NOUN
ecletica-1352	110	20	hybrid	hybrid	ADJ
ecletica-1352	110	21	atomic	atomic	ADJ
ecletica-1352	110	22	orbitals	orbital	NOUN
ecletica-1352	110	23	σ	σ	PROPN
ecletica-1352	110	24	cd1	cd1	PROPN
ecletica-1352	110	25	–	–	PUNCT
ecletica-1352	110	26	o3	o3	PROPN
ecletica-1352	110	27	1.696	1.696	NUM
ecletica-1352	110	28	sp0.58	sp0.58	PROPN
ecletica-1352	110	29	s(63.28%)p(36.51%)d(0.22	s(63.28%)p(36.51%)d(0.22	NOUN
ecletica-1352	110	30	%	%	NOUN
ecletica-1352	110	31	)	)	PUNCT
ecletica-1352	111	1	σ	σ	PROPN
ecletica-1352	111	2	c6	c6	PROPN
ecletica-1352	111	3	–	–	PUNCT
ecletica-1352	111	4	c8	c8	PROPN
ecletica-1352	111	5	1.947	1.947	NUM
ecletica-1352	111	6	sp2.33	sp2.33	NOUN
ecletica-1352	111	7	s(29.99%)p(70.01	s(29.99%)p(70.01	NOUN
ecletica-1352	111	8	%	%	NOUN
ecletica-1352	111	9	)	)	PUNCT
ecletica-1352	112	1	σ	σ	PROPN
ecletica-1352	112	2	c6	c6	PROPN
ecletica-1352	112	3	–	–	PUNCT
ecletica-1352	112	4	h63	h63	NOUN
ecletica-1352	112	5	1.946	1.946	NUM
ecletica-1352	112	6	sp2.71	sp2.71	PROPN
ecletica-1352	112	7	s(26.98%)p(73.02	s(26.98%)p(73.02	PROPN
ecletica-1352	112	8	%	%	NOUN
ecletica-1352	112	9	)	)	PUNCT
ecletica-1352	113	1	σ	σ	PROPN
ecletica-1352	113	2	c7	c7	PROPN
ecletica-1352	113	3	–	–	PUNCT
ecletica-1352	113	4	c17	c17	NOUN
ecletica-1352	113	5	1.947	1.947	NUM
ecletica-1352	113	6	sp2.91	sp2.91	PROPN
ecletica-1352	113	7	s(25.60%)p(74.40	s(25.60%)p(74.40	PROPN
ecletica-1352	113	8	%	%	PROPN
ecletica-1352	113	9	)	)	PUNCT
ecletica-1352	114	1	σ	σ	PROPN
ecletica-1352	114	2	c7	c7	PROPN
ecletica-1352	114	3	–	–	PUNCT
ecletica-1352	114	4	h62	h62	NOUN
ecletica-1352	114	5	1.932	1.932	NUM
ecletica-1352	114	6	sp2.69	sp2.69	NOUN
ecletica-1352	114	7	s(27.07%)p(72.93	s(27.07%)p(72.93	PROPN
ecletica-1352	114	8	%	%	NOUN
ecletica-1352	114	9	)	)	PUNCT
ecletica-1352	114	10	lp	lp	NOUN
ecletica-1352	114	11	(	(	PUNCT
ecletica-1352	114	12	2)cd1	2)cd1	PROPN
ecletica-1352	114	13	1.999	1.999	NUM
ecletica-1352	114	14	spd1	spd1	PROPN
ecletica-1352	114	15	s(0.00%)p0.00(0.01%)d	s(0.00%)p0.00(0.01%)d	PROPN
ecletica-1352	114	16	1.00(99.99	1.00(99.99	PROPN
ecletica-1352	114	17	%	%	NOUN
ecletica-1352	114	18	)	)	PUNCT
ecletica-1352	115	1	lp*(6)cd1	lp*(6)cd1	VERB
ecletica-1352	115	2	0.505	0.505	NUM
ecletica-1352	115	3	sp1.83	sp1.83	NOUN
ecletica-1352	115	4	s(35.29%)p(64.70%)d(0.01	s(35.29%)p(64.70%)d(0.01	VERB
ecletica-1352	115	5	%	%	NOUN
ecletica-1352	115	6	)	)	PUNCT
ecletica-1352	115	7	lp	lp	NOUN
ecletica-1352	115	8	(	(	PUNCT
ecletica-1352	115	9	2	2	X
ecletica-1352	115	10	)	)	PUNCT
ecletica-1352	115	11	o2	o2	ADJ
ecletica-1352	115	12	1.868	1.868	NUM
ecletica-1352	115	13	sp1.30	sp1.30	NOUN
ecletica-1352	115	14	s(43.44%)p(56.56	s(43.44%)p(56.56	VERB
ecletica-1352	115	15	%	%	NOUN
ecletica-1352	115	16	)	)	PUNCT
ecletica-1352	116	1	σ	σ	PROPN
ecletica-1352	116	2	*	*	PUNCT
ecletica-1352	116	3	cd1	cd1	PROPN
ecletica-1352	116	4	–	–	PUNCT
ecletica-1352	116	5	o3	o3	PROPN
ecletica-1352	116	6	0.420	0.420	NUM
ecletica-1352	116	7	sp0.58	sp0.58	VERB
ecletica-1352	116	8	s(63.28%)p(36.51%)d(0.22	s(63.28%)p(36.51%)d(0.22	NOUN
ecletica-1352	116	9	%	%	NOUN
ecletica-1352	116	10	)	)	PUNCT
ecletica-1352	117	1	σ	σ	PROPN
ecletica-1352	117	2	*	*	PROPN
ecletica-1352	117	3	c6	c6	PROPN
ecletica-1352	117	4	–	–	PUNCT
ecletica-1352	117	5	c8	c8	PROPN
ecletica-1352	117	6	0.0705	0.0705	NUM
ecletica-1352	117	7	sp2.84	sp2.84	PROPN
ecletica-1352	117	8	s(26.02%)p(73.98	s(26.02%)p(73.98	PROPN
ecletica-1352	117	9	%	%	NOUN
ecletica-1352	117	10	)	)	PUNCT
ecletica-1352	117	11	σ*c6	σ*c6	PROPN
ecletica-1352	117	12	–	–	PUNCT
ecletica-1352	117	13	h63	h63	PROPN
ecletica-1352	117	14	0.047	0.047	NUM
ecletica-1352	117	15	sp2.71	sp2.71	PROPN
ecletica-1352	117	16	s(26.98%)p(73.02	s(26.98%)p(73.02	PROPN
ecletica-1352	117	17	%	%	NOUN
ecletica-1352	117	18	)	)	PUNCT
ecletica-1352	117	19	σ*c7	σ*c7	NOUN
ecletica-1352	117	20	–	–	PUNCT
ecletica-1352	117	21	c17	c17	NOUN
ecletica-1352	117	22	0.070	0.070	NUM
ecletica-1352	117	23	sp2.35	sp2.35	PROPN
ecletica-1352	117	24	s(29.83%)p(70.17	s(29.83%)p(70.17	PROPN
ecletica-1352	117	25	%	%	NOUN
ecletica-1352	117	26	)	)	PUNCT
ecletica-1352	117	27	σ*c7	σ*c7	NOUN
ecletica-1352	117	28	–	–	PUNCT
ecletica-1352	117	29	h62	h62	NOUN
ecletica-1352	117	30	0.047	0.047	NUM
ecletica-1352	117	31	sp2.69	sp2.69	NOUN
ecletica-1352	117	32	s(27.07%)p(72.93	s(27.07%)p(72.93	PROPN
ecletica-1352	117	33	%	%	NOUN
ecletica-1352	117	34	)	)	PUNCT
ecletica-1352	117	35	source	source	NOUN
ecletica-1352	117	36	:	:	PUNCT
ecletica-1352	117	37	elaborated	elaborate	VERB
ecletica-1352	117	38	by	by	ADP
ecletica-1352	117	39	the	the	DET
ecletica-1352	117	40	authors	author	NOUN
ecletica-1352	117	41	using	use	VERB
ecletica-1352	117	42	data	datum	NOUN
ecletica-1352	117	43	from	from	ADP
ecletica-1352	117	44	bisong	bisong	ADP
ecletica-1352	117	45	et	et	PROPN
ecletica-1352	117	46	al	al	PROPN
ecletica-1352	117	47	.	.	PROPN
ecletica-1352	117	48	(	(	PUNCT
ecletica-1352	117	49	2020	2020	NUM
ecletica-1352	117	50	)	)	PUNCT
ecletica-1352	117	51	.	.	PUNCT
ecletica-1352	118	1	the	the	DET
ecletica-1352	118	2	second	second	ADJ
ecletica-1352	118	3	order	order	NOUN
ecletica-1352	118	4	perturbation	perturbation	NOUN
ecletica-1352	118	5	theory	theory	NOUN
ecletica-1352	118	6	analysis	analysis	NOUN
ecletica-1352	118	7	of	of	ADP
ecletica-1352	118	8	fock	fock	ADJ
ecletica-1352	118	9	matrix	matrix	NOUN
ecletica-1352	118	10	basis	basis	NOUN
ecletica-1352	118	11	nbo	nbo	NOUN
ecletica-1352	118	12	analysis	analysis	NOUN
ecletica-1352	118	13	between	between	ADP
ecletica-1352	118	14	donor	donor	NOUN
ecletica-1352	118	15	and	and	CCONJ
ecletica-1352	118	16	acceptor	acceptor	NOUN
ecletica-1352	118	17	orbitals	orbital	NOUN
ecletica-1352	118	18	of	of	ADP
ecletica-1352	118	19	the	the	DET
ecletica-1352	118	20	studied	study	VERB
ecletica-1352	118	21	compound	compound	NOUN
ecletica-1352	118	22	are	be	AUX
ecletica-1352	118	23	represented	represent	VERB
ecletica-1352	118	24	in	in	ADP
ecletica-1352	118	25	tab	tab	NOUN
ecletica-1352	118	26	.	.	PUNCT
ecletica-1352	119	1	6	6	NUM
ecletica-1352	119	2	.	.	X
ecletica-1352	119	3	the	the	DET
ecletica-1352	119	4	nature	nature	NOUN
ecletica-1352	119	5	of	of	ADP
ecletica-1352	119	6	the	the	DET
ecletica-1352	119	7	interaction	interaction	NOUN
ecletica-1352	119	8	between	between	ADP
ecletica-1352	119	9	the	the	DET
ecletica-1352	119	10	donor	donor	NOUN
ecletica-1352	119	11	and	and	CCONJ
ecletica-1352	119	12	acceptor	acceptor	NOUN
ecletica-1352	119	13	are	be	AUX
ecletica-1352	119	14	determined	determine	VERB
ecletica-1352	119	15	by	by	ADP
ecletica-1352	119	16	the	the	DET
ecletica-1352	119	17	value	value	NOUN
ecletica-1352	119	18	of	of	ADP
ecletica-1352	119	19	the	the	DET
ecletica-1352	119	20	stabilization	stabilization	NOUN
ecletica-1352	119	21	energy	energy	NOUN
ecletica-1352	119	22	(	(	PUNCT
ecletica-1352	119	23	khan	khan	PROPN
ecletica-1352	119	24	et	et	PROPN
ecletica-1352	119	25	al	al	PROPN
ecletica-1352	119	26	.	.	PROPN
ecletica-1352	119	27	,	,	PUNCT
ecletica-1352	119	28	2020	2020	NUM
ecletica-1352	119	29	)	)	PUNCT
ecletica-1352	119	30	.	.	PUNCT
ecletica-1352	120	1	the	the	DET
ecletica-1352	120	2	stability	stability	NOUN
ecletica-1352	120	3	of	of	ADP
ecletica-1352	120	4	the	the	DET
ecletica-1352	120	5	system	system	NOUN
ecletica-1352	120	6	increases	increase	VERB
ecletica-1352	120	7	with	with	ADP
ecletica-1352	120	8	increased	increase	VERB
ecletica-1352	120	9	electron	electron	NOUN
ecletica-1352	120	10	delocalization	delocalization	NOUN
ecletica-1352	120	11	associated	associate	VERB
ecletica-1352	120	12	with	with	ADP
ecletica-1352	120	13	hyper	hyper	NOUN
ecletica-1352	120	14	-	-	NOUN
ecletica-1352	120	15	conjugation	conjugation	NOUN
ecletica-1352	120	16	,	,	PUNCT
ecletica-1352	120	17	thus	thus	ADV
ecletica-1352	120	18	a	a	DET
ecletica-1352	120	19	high	high	ADJ
ecletica-1352	120	20	stabilization	stabilization	NOUN
ecletica-1352	120	21	energy	energy	NOUN
ecletica-1352	120	22	,	,	PUNCT
ecletica-1352	120	23	the	the	DET
ecletica-1352	120	24	significant	significant	ADJ
ecletica-1352	120	25	hyperconjugative	hyperconjugative	ADJ
ecletica-1352	120	26	interactions	interaction	NOUN
ecletica-1352	120	27	and	and	CCONJ
ecletica-1352	120	28	the	the	DET
ecletica-1352	120	29	value	value	NOUN
ecletica-1352	120	30	of	of	ADP
ecletica-1352	120	31	their	their	PRON
ecletica-1352	120	32	stabilization	stabilization	NOUN
ecletica-1352	120	33	energies	energy	NOUN
ecletica-1352	120	34	observed	observe	VERB
ecletica-1352	120	35	from	from	ADP
ecletica-1352	120	36	the	the	DET
ecletica-1352	120	37	nbo	nbo	PROPN
ecletica-1352	120	38	analysis	analysis	NOUN
ecletica-1352	120	39	are	be	AUX
ecletica-1352	120	40	:	:	PUNCT
ecletica-1352	120	41	π*(c	π*(c	NOUN
ecletica-1352	120	42	38	38	NUM
ecletica-1352	120	43	–	–	PUNCT
ecletica-1352	120	44	o	o	NOUN
ecletica-1352	120	45	39	39	NUM
ecletica-1352	120	46	)	)	PUNCT
ecletica-1352	120	47	→	→	SYM
ecletica-1352	121	1	π	π	X
ecletica-1352	121	2	*	*	PUNCT
ecletica-1352	121	3	(	(	PUNCT
ecletica-1352	121	4	c	c	NOUN
ecletica-1352	121	5	9	9	NUM
ecletica-1352	121	6	–	–	PUNCT
ecletica-1352	121	7	c	c	NOUN
ecletica-1352	121	8	11	11	NUM
ecletica-1352	121	9	)	)	PUNCT
ecletica-1352	121	10	,	,	PUNCT
ecletica-1352	121	11	106.15	106.15	NUM
ecletica-1352	121	12	kcal	kcal	NOUN
ecletica-1352	121	13	mol-1	mol-1	NUM
ecletica-1352	121	14	;	;	PUNCT
ecletica-1352	121	15	π*(c	π*(c	NOUN
ecletica-1352	121	16	42	42	NUM
ecletica-1352	121	17	–	–	PUNCT
ecletica-1352	121	18	o	o	NOUN
ecletica-1352	121	19	43	43	NUM
ecletica-1352	121	20	)	)	PUNCT
ecletica-1352	121	21	→	→	SYM
ecletica-1352	121	22	π	π	X
ecletica-1352	121	23	*	*	PUNCT
ecletica-1352	121	24	(	(	PUNCT
ecletica-1352	121	25	c	c	NOUN
ecletica-1352	121	26	13	13	NUM
ecletica-1352	121	27	–	–	PUNCT
ecletica-1352	121	28	c	c	NOUN
ecletica-1352	121	29	15	15	NUM
ecletica-1352	121	30	)	)	PUNCT
ecletica-1352	121	31	,	,	PUNCT
ecletica-1352	121	32	87.31	87.31	NUM
ecletica-1352	121	33	kcal	kcal	NOUN
ecletica-1352	121	34	mol–1	mol–1	NOUN
ecletica-1352	121	35	;	;	PUNCT
ecletica-1352	121	36	π	π	X
ecletica-1352	121	37	*	*	PUNCT
ecletica-1352	121	38	(	(	PUNCT
ecletica-1352	121	39	c	c	NOUN
ecletica-1352	121	40	58	58	NUM
ecletica-1352	121	41	–	–	PUNCT
ecletica-1352	121	42	o	o	NOUN
ecletica-1352	121	43	59	59	NUM
ecletica-1352	121	44	)	)	PUNCT
ecletica-1352	121	45	→	→	SYM
ecletica-1352	121	46	π	π	X
ecletica-1352	121	47	*	*	PUNCT
ecletica-1352	121	48	(	(	PUNCT
ecletica-1352	121	49	c	c	NOUN
ecletica-1352	121	50	22	22	NUM
ecletica-1352	121	51	–	–	PUNCT
ecletica-1352	121	52	c	c	NOUN
ecletica-1352	121	53	24	24	NUM
ecletica-1352	121	54	)	)	PUNCT
ecletica-1352	121	55	,	,	PUNCT
ecletica-1352	121	56	82.21	82.21	NUM
ecletica-1352	121	57	kcal	kcal	NOUN
ecletica-1352	121	58	mol–1	mol–1	NOUN
ecletica-1352	121	59	;	;	PUNCT
ecletica-1352	121	60	lp	lp	PROPN
ecletica-1352	121	61	*	*	PUNCT
ecletica-1352	121	62	(	(	PUNCT
ecletica-1352	121	63	cd	cd	PROPN
ecletica-1352	121	64	1	1	NUM
ecletica-1352	121	65	)	)	PUNCT
ecletica-1352	121	66	→	→	PUNCT
ecletica-1352	121	67	σ	σ	X
ecletica-1352	121	68	*	*	PROPN
ecletica-1352	121	69	(	(	PUNCT
ecletica-1352	121	70	cd	cd	PROPN
ecletica-1352	121	71	1	1	NUM
ecletica-1352	121	72	–	–	PUNCT
ecletica-1352	121	73	o	o	NOUN
ecletica-1352	121	74	3	3	NUM
ecletica-1352	121	75	)	)	PUNCT
ecletica-1352	121	76	,	,	PUNCT
ecletica-1352	121	77	95.04	95.04	NUM
ecletica-1352	121	78	kcal	kcal	NOUN
ecletica-1352	121	79	mol–1	mol–1	NOUN
ecletica-1352	121	80	;	;	PUNCT
ecletica-1352	121	81	lp	lp	PROPN
ecletica-1352	121	82	(	(	PUNCT
ecletica-1352	121	83	o	o	NOUN
ecletica-1352	121	84	66	66	NUM
ecletica-1352	121	85	)	)	PUNCT
ecletica-1352	121	86	→	→	SYM
ecletica-1352	121	87	lp*(cd	lp*(cd	PROPN
ecletica-1352	121	88	1	1	NUM
ecletica-1352	121	89	)	)	PUNCT
ecletica-1352	121	90	,	,	PUNCT
ecletica-1352	121	91	79.94	79.94	NUM
ecletica-1352	121	92	kcal	kcal	ADJ
ecletica-1352	121	93	mol–1	mol–1	NOUN
ecletica-1352	121	94	.	.	PUNCT
ecletica-1352	122	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	122	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	122	3	original	original	ADJ
ecletica-1352	122	4	article	article	NOUN
ecletica-1352	122	5	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	122	6	43	43	NUM
ecletica-1352	122	7	eclética	eclética	PROPN
ecletica-1352	122	8	química	química	PROPN
ecletica-1352	122	9	journal	journal	PROPN
ecletica-1352	122	10	,	,	PUNCT
ecletica-1352	122	11	vol	vol	NOUN
ecletica-1352	122	12	.	.	PROPN
ecletica-1352	122	13	47	47	NUM
ecletica-1352	122	14	,	,	PUNCT
ecletica-1352	122	15	n.	n.	NOUN
ecletica-1352	122	16	4	4	NUM
ecletica-1352	122	17	,	,	PUNCT
ecletica-1352	122	18	2022	2022	NUM
ecletica-1352	122	19	,	,	PUNCT
ecletica-1352	122	20	37	37	NUM
ecletica-1352	122	21	-	-	SYM
ecletica-1352	122	22	50	50	NUM
ecletica-1352	122	23	issn	issn	NOUN
ecletica-1352	122	24	:	:	PUNCT
ecletica-1352	122	25	1678	1678	NUM
ecletica-1352	122	26	-	-	SYM
ecletica-1352	122	27	4618	4618	NUM
ecletica-1352	122	28	doi	doi	NOUN
ecletica-1352	122	29	:	:	PUNCT
ecletica-1352	122	30	10.26850/1678	10.26850/1678	NUM
ecletica-1352	122	31	-	-	PUNCT
ecletica-1352	122	32	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	ADJ
ecletica-1352	122	33	-	-	PUNCT
ecletica-1352	122	34	50	50	NUM
ecletica-1352	122	35	table	table	NOUN
ecletica-1352	122	36	6	6	NUM
ecletica-1352	122	37	.	.	PUNCT
ecletica-1352	123	1	donor	donor	NOUN
ecletica-1352	123	2	,	,	PUNCT
ecletica-1352	123	3	acceptor	acceptor	NOUN
ecletica-1352	123	4	,	,	PUNCT
ecletica-1352	123	5	occupancy	occupancy	NOUN
ecletica-1352	123	6	and	and	CCONJ
ecletica-1352	123	7	the	the	DET
ecletica-1352	123	8	second	second	ADJ
ecletica-1352	123	9	order	order	NOUN
ecletica-1352	123	10	perturbation	perturbation	NOUN
ecletica-1352	123	11	energies	energy	NOUN
ecletica-1352	123	12	of	of	ADP
ecletica-1352	123	13	cd	cd	PROPN
ecletica-1352	123	14	complex	complex	NOUN
ecletica-1352	123	15	calculated	calculate	VERB
ecletica-1352	123	16	at	at	ADP
ecletica-1352	123	17	dft	dft	PROPN
ecletica-1352	123	18	/	/	SYM
ecletica-1352	123	19	b3lyp	b3lyp	PROPN
ecletica-1352	123	20	.	.	PUNCT
ecletica-1352	124	1	donor	donor	NOUN
ecletica-1352	124	2	(	(	PUNCT
ecletica-1352	124	3	i	i	NOUN
ecletica-1352	124	4	)	)	PUNCT
ecletica-1352	124	5	(	(	PUNCT
ecletica-1352	124	6	a.u	a.u	PROPN
ecletica-1352	124	7	.	.	NOUN
ecletica-1352	124	8	)	)	PUNCT
ecletica-1352	125	1	occupancy	occupancy	NOUN
ecletica-1352	125	2	(	(	PUNCT
ecletica-1352	125	3	j	j	NOUN
ecletica-1352	125	4	)	)	PUNCT
ecletica-1352	125	5	(	(	PUNCT
ecletica-1352	125	6	a.u	a.u	PROPN
ecletica-1352	125	7	.	.	NOUN
ecletica-1352	125	8	)	)	PUNCT
ecletica-1352	125	9	acceptor	acceptor	NOUN
ecletica-1352	125	10	(	(	PUNCT
ecletica-1352	125	11	j	j	NOUN
ecletica-1352	125	12	)	)	PUNCT
ecletica-1352	125	13	occupancy	occupancy	NOUN
ecletica-1352	125	14	(	(	PUNCT
ecletica-1352	125	15	e	e	NOUN
ecletica-1352	125	16	)	)	PUNCT
ecletica-1352	125	17	e2	e2	PROPN
ecletica-1352	125	18	(	(	PUNCT
ecletica-1352	125	19	kcal	kcal	X
ecletica-1352	125	20	mol–1	mol–1	NOUN
ecletica-1352	125	21	)	)	PUNCT
ecletica-1352	125	22	e(j	e(j	PROPN
ecletica-1352	125	23	)	)	PUNCT
ecletica-1352	125	24	–	–	PUNCT
ecletica-1352	125	25	e(i	e(i	PROPN
ecletica-1352	125	26	)	)	PUNCT
ecletica-1352	125	27	(	(	PUNCT
ecletica-1352	125	28	a.u	a.u	PROPN
ecletica-1352	125	29	.	.	PUNCT
ecletica-1352	125	30	)	)	PUNCT
ecletica-1352	126	1	π	π	PROPN
ecletica-1352	126	2	*	*	PUNCT
ecletica-1352	126	3	c38	c38	NOUN
ecletica-1352	126	4	–	–	PUNCT
ecletica-1352	126	5	o39	o39	NOUN
ecletica-1352	126	6	(	(	PUNCT
ecletica-1352	126	7	0.233	0.233	NUM
ecletica-1352	126	8	)	)	PUNCT
ecletica-1352	126	9	π	π	PROPN
ecletica-1352	126	10	*	*	PUNCT
ecletica-1352	126	11	c9	c9	NOUN
ecletica-1352	126	12	–	–	PUNCT
ecletica-1352	126	13	c11	c11	NOUN
ecletica-1352	126	14	(	(	PUNCT
ecletica-1352	126	15	0.346	0.346	NUM
ecletica-1352	126	16	)	)	PUNCT
ecletica-1352	126	17	106.15	106.15	NUM
ecletica-1352	126	18	0.01	0.01	NUM
ecletica-1352	126	19	π	π	X
ecletica-1352	126	20	*	*	PUNCT
ecletica-1352	126	21	c42	c42	PROPN
ecletica-1352	126	22	–	–	PUNCT
ecletica-1352	126	23	o43	o43	NOUN
ecletica-1352	126	24	(	(	PUNCT
ecletica-1352	126	25	0.233	0.233	NUM
ecletica-1352	126	26	)	)	PUNCT
ecletica-1352	127	1	π	π	PROPN
ecletica-1352	127	2	*	*	PROPN
ecletica-1352	127	3	c22	c22	PROPN
ecletica-1352	127	4	–	–	PUNCT
ecletica-1352	127	5	c24	c24	NOUN
ecletica-1352	127	6	(	(	PUNCT
ecletica-1352	127	7	0.337	0.337	NUM
ecletica-1352	127	8	)	)	PUNCT
ecletica-1352	127	9	82.21	82.21	NUM
ecletica-1352	127	10	0.02	0.02	NUM
ecletica-1352	127	11	lp*(6	lp*(6	PROPN
ecletica-1352	127	12	)	)	PUNCT
ecletica-1352	127	13	cd	cd	NOUN
ecletica-1352	127	14	1	1	NUM
ecletica-1352	127	15	(	(	PUNCT
ecletica-1352	127	16	0.505	0.505	NUM
ecletica-1352	127	17	)	)	PUNCT
ecletica-1352	127	18	σ	σ	PROPN
ecletica-1352	127	19	*	*	PROPN
ecletica-1352	127	20	cd1	cd1	PROPN
ecletica-1352	127	21	–	–	PUNCT
ecletica-1352	127	22	o3	o3	PROPN
ecletica-1352	127	23	(	(	PUNCT
ecletica-1352	127	24	0.420	0.420	NUM
ecletica-1352	127	25	)	)	PUNCT
ecletica-1352	127	26	95.04	95.04	NUM
ecletica-1352	127	27	0.04	0.04	NUM
ecletica-1352	127	28	π	π	SYM
ecletica-1352	127	29	*	*	PUNCT
ecletica-1352	127	30	c42	c42	PROPN
ecletica-1352	127	31	–	–	PUNCT
ecletica-1352	127	32	o43	o43	NOUN
ecletica-1352	127	33	(	(	PUNCT
ecletica-1352	127	34	0.232	0.232	NUM
ecletica-1352	127	35	)	)	PUNCT
ecletica-1352	128	1	π	π	PROPN
ecletica-1352	128	2	*	*	X
ecletica-1352	128	3	c13	c13	PROPN
ecletica-1352	128	4	–	–	PUNCT
ecletica-1352	128	5	c15	c15	NOUN
ecletica-1352	128	6	(	(	PUNCT
ecletica-1352	128	7	0.336	0.336	NUM
ecletica-1352	128	8	)	)	PUNCT
ecletica-1352	128	9	87.31	87.31	NUM
ecletica-1352	128	10	0.01	0.01	NUM
ecletica-1352	128	11	lp(2	lp(2	NOUN
ecletica-1352	128	12	)	)	PUNCT
ecletica-1352	128	13	o4	o4	PROPN
ecletica-1352	128	14	(	(	PUNCT
ecletica-1352	128	15	1.795	1.795	NUM
ecletica-1352	128	16	)	)	PUNCT
ecletica-1352	128	17	lp*(8	lp*(8	PROPN
ecletica-1352	128	18	)	)	PUNCT
ecletica-1352	129	1	cd1	cd1	NOUN
ecletica-1352	129	2	(	(	PUNCT
ecletica-1352	129	3	0.358	0.358	NUM
ecletica-1352	129	4	)	)	PUNCT
ecletica-1352	129	5	56.68	56.68	NUM
ecletica-1352	129	6	0.56	0.56	NUM
ecletica-1352	129	7	σ	σ	PRON
ecletica-1352	129	8	o2	o2	PROPN
ecletica-1352	129	9	–	–	PUNCT
ecletica-1352	129	10	o37	o37	NOUN
ecletica-1352	129	11	(	(	PUNCT
ecletica-1352	129	12	1.821	1.821	NUM
ecletica-1352	129	13	)	)	PUNCT
ecletica-1352	129	14	lp*(6	lp*(6	PROPN
ecletica-1352	129	15	)	)	PUNCT
ecletica-1352	129	16	cd1	cd1	NOUN
ecletica-1352	129	17	(	(	PUNCT
ecletica-1352	129	18	0.505	0.505	NUM
ecletica-1352	129	19	)	)	PUNCT
ecletica-1352	129	20	49.61	49.61	NUM
ecletica-1352	129	21	0.25	0.25	NUM
ecletica-1352	129	22	π	π	PROPN
ecletica-1352	129	23	c22	c22	PROPN
ecletica-1352	129	24	–	–	PUNCT
ecletica-1352	129	25	c24	c24	NOUN
ecletica-1352	129	26	(	(	PUNCT
ecletica-1352	129	27	1.628	1.628	NUM
ecletica-1352	129	28	)	)	PUNCT
ecletica-1352	130	1	π	π	PROPN
ecletica-1352	130	2	*	*	PUNCT
ecletica-1352	130	3	c17	c17	NOUN
ecletica-1352	130	4	–	–	PUNCT
ecletica-1352	130	5	c19	c19	NOUN
ecletica-1352	130	6	(	(	PUNCT
ecletica-1352	130	7	0.341	0.341	NUM
ecletica-1352	130	8	)	)	PUNCT
ecletica-1352	130	9	24.11	24.11	NUM
ecletica-1352	130	10	0.28	0.28	NUM
ecletica-1352	130	11	σ	σ	NUM
ecletica-1352	130	12	cd1	cd1	PROPN
ecletica-1352	130	13	–	–	PUNCT
ecletica-1352	130	14	o3	o3	PROPN
ecletica-1352	130	15	(	(	PUNCT
ecletica-1352	130	16	1.821	1.821	NUM
ecletica-1352	130	17	)	)	PUNCT
ecletica-1352	130	18	π	π	PROPN
ecletica-1352	130	19	*	*	PUNCT
ecletica-1352	130	20	c26	c26	NOUN
ecletica-1352	130	21	–	–	PUNCT
ecletica-1352	130	22	o27	o27	NOUN
ecletica-1352	130	23	(	(	PUNCT
ecletica-1352	130	24	0.350	0.350	NUM
ecletica-1352	130	25	)	)	PUNCT
ecletica-1352	130	26	28.91	28.91	NUM
ecletica-1352	130	27	0.29	0.29	NUM
ecletica-1352	130	28	π	π	PROPN
ecletica-1352	130	29	c28	c28	NOUN
ecletica-1352	130	30	–	–	PUNCT
ecletica-1352	130	31	c30	c30	NOUN
ecletica-1352	130	32	(	(	PUNCT
ecletica-1352	130	33	0.233	0.233	NUM
ecletica-1352	130	34	)	)	PUNCT
ecletica-1352	131	1	π	π	PROPN
ecletica-1352	131	2	*	*	PUNCT
ecletica-1352	131	3	c29	c29	PROPN
ecletica-1352	131	4	–	–	PUNCT
ecletica-1352	131	5	c31	c31	NOUN
ecletica-1352	131	6	(	(	PUNCT
ecletica-1352	131	7	0.337	0.337	NUM
ecletica-1352	131	8	)	)	PUNCT
ecletica-1352	131	9	23.32	23.32	NUM
ecletica-1352	131	10	0.07	0.07	NUM
ecletica-1352	131	11	lp	lp	NOUN
ecletica-1352	131	12	(	(	PUNCT
ecletica-1352	131	13	2	2	NUM
ecletica-1352	131	14	)	)	PUNCT
ecletica-1352	131	15	o66	o66	NOUN
ecletica-1352	131	16	(	(	PUNCT
ecletica-1352	131	17	1.824	1.824	NUM
ecletica-1352	131	18	)	)	PUNCT
ecletica-1352	131	19	lp*(6)cd1	lp*(6)cd1	PUNCT
ecletica-1352	131	20	(	(	PUNCT
ecletica-1352	131	21	0.505	0.505	NUM
ecletica-1352	131	22	)	)	PUNCT
ecletica-1352	131	23	79.94	79.94	NUM
ecletica-1352	131	24	0.56	0.56	NUM
ecletica-1352	131	25	lp(2	lp(2	NOUN
ecletica-1352	131	26	)	)	PUNCT
ecletica-1352	131	27	o	o	NOUN
ecletica-1352	131	28	4	4	NUM
ecletica-1352	131	29	(	(	PUNCT
ecletica-1352	131	30	1.829	1.829	NUM
ecletica-1352	131	31	)	)	PUNCT
ecletica-1352	131	32	σ*cd1	σ*cd1	NOUN
ecletica-1352	131	33	–	–	PUNCT
ecletica-1352	131	34	o	o	NOUN
ecletica-1352	131	35	3	3	NUM
ecletica-1352	131	36	(	(	PUNCT
ecletica-1352	131	37	0.420	0.420	NUM
ecletica-1352	131	38	)	)	PUNCT
ecletica-1352	131	39	43.95	43.95	NUM
ecletica-1352	131	40	0.51	0.51	NUM
ecletica-1352	131	41	lp	lp	NOUN
ecletica-1352	131	42	(	(	PUNCT
ecletica-1352	131	43	2	2	NUM
ecletica-1352	131	44	)	)	PUNCT
ecletica-1352	131	45	o66	o66	NOUN
ecletica-1352	131	46	(	(	PUNCT
ecletica-1352	131	47	1.824	1.824	NUM
ecletica-1352	131	48	)	)	PUNCT
ecletica-1352	131	49	lp*(7)cd1	lp*(7)cd1	PROPN
ecletica-1352	131	50	(	(	PUNCT
ecletica-1352	131	51	0.394	0.394	NUM
ecletica-1352	131	52	)	)	PUNCT
ecletica-1352	131	53	41.61	41.61	NUM
ecletica-1352	131	54	0.59	0.59	NUM
ecletica-1352	131	55	source	source	NOUN
ecletica-1352	131	56	:	:	PUNCT
ecletica-1352	131	57	elaborated	elaborate	VERB
ecletica-1352	131	58	by	by	ADP
ecletica-1352	131	59	the	the	DET
ecletica-1352	131	60	authors	author	NOUN
ecletica-1352	131	61	using	use	VERB
ecletica-1352	131	62	data	datum	NOUN
ecletica-1352	131	63	from	from	ADP
ecletica-1352	131	64	bisong	bisong	ADP
ecletica-1352	131	65	et	et	PROPN
ecletica-1352	131	66	al	al	PROPN
ecletica-1352	131	67	.	.	PROPN
ecletica-1352	131	68	(	(	PUNCT
ecletica-1352	131	69	2020	2020	NUM
ecletica-1352	131	70	)	)	PUNCT
ecletica-1352	131	71	.	.	PUNCT
ecletica-1352	132	1	3.4	3.4	NUM
ecletica-1352	132	2	molecular	molecular	ADJ
ecletica-1352	132	3	docking	dock	VERB
ecletica-1352	132	4	the	the	DET
ecletica-1352	132	5	crystal	crystal	NOUN
ecletica-1352	132	6	structure	structure	NOUN
ecletica-1352	132	7	of	of	ADP
ecletica-1352	132	8	the	the	DET
ecletica-1352	132	9	targeted	target	VERB
ecletica-1352	132	10	proteins	protein	NOUN
ecletica-1352	132	11	was	be	AUX
ecletica-1352	132	12	obtained	obtain	VERB
ecletica-1352	132	13	from	from	ADP
ecletica-1352	132	14	the	the	DET
ecletica-1352	132	15	protein	protein	NOUN
ecletica-1352	132	16	data	datum	NOUN
ecletica-1352	132	17	bank	bank	NOUN
ecletica-1352	132	18	(	(	PUNCT
ecletica-1352	132	19	pdb	pdb	PROPN
ecletica-1352	132	20	ids	ids	PROPN
ecletica-1352	132	21	:	:	PUNCT
ecletica-1352	132	22	1d7u	1d7u	NUM
ecletica-1352	132	23	and	and	CCONJ
ecletica-1352	132	24	2xcs	2xcs	NUM
ecletica-1352	132	25	)	)	PUNCT
ecletica-1352	132	26	for	for	ADP
ecletica-1352	132	27	the	the	DET
ecletica-1352	132	28	evaluation	evaluation	NOUN
ecletica-1352	132	29	of	of	ADP
ecletica-1352	132	30	antimicrobial	antimicrobial	ADJ
ecletica-1352	132	31	mechanism	mechanism	NOUN
ecletica-1352	132	32	.	.	PUNCT
ecletica-1352	133	1	the	the	DET
ecletica-1352	133	2	following	follow	VERB
ecletica-1352	133	3	properties	property	NOUN
ecletica-1352	133	4	are	be	AUX
ecletica-1352	133	5	all	all	PRON
ecletica-1352	133	6	part	part	NOUN
ecletica-1352	133	7	of	of	ADP
ecletica-1352	133	8	the	the	DET
ecletica-1352	133	9	traditional	traditional	ADJ
ecletica-1352	133	10	drug	drug	NOUN
ecletica-1352	133	11	design	design	NOUN
ecletica-1352	133	12	and	and	CCONJ
ecletica-1352	133	13	development	development	NOUN
ecletica-1352	133	14	process	process	NOUN
ecletica-1352	133	15	:	:	PUNCT
ecletica-1352	133	16	physical	physical	ADJ
ecletica-1352	133	17	characteristic	characteristic	NOUN
ecletica-1352	133	18	,	,	PUNCT
ecletica-1352	133	19	substantiation	substantiation	NOUN
ecletica-1352	133	20	,	,	PUNCT
ecletica-1352	133	21	preclinical	preclinical	ADJ
ecletica-1352	133	22	and	and	CCONJ
ecletica-1352	133	23	clinical	clinical	ADJ
ecletica-1352	133	24	trials	trial	NOUN
ecletica-1352	133	25	(	(	PUNCT
ecletica-1352	133	26	izuchukwu	izuchukwu	PROPN
ecletica-1352	133	27	et	et	PROPN
ecletica-1352	133	28	al	al	PROPN
ecletica-1352	133	29	.	.	PROPN
ecletica-1352	133	30	,	,	PUNCT
ecletica-1352	133	31	2022	2022	NUM
ecletica-1352	133	32	;	;	PUNCT
ecletica-1352	133	33	udoikono	udoikono	PROPN
ecletica-1352	133	34	et	et	PROPN
ecletica-1352	133	35	al	al	PROPN
ecletica-1352	133	36	.	.	PROPN
ecletica-1352	133	37	,	,	PUNCT
ecletica-1352	133	38	2022	2022	NUM
ecletica-1352	133	39	)	)	PUNCT
ecletica-1352	133	40	.	.	PUNCT
ecletica-1352	134	1	thus	thus	ADV
ecletica-1352	134	2	,	,	PUNCT
ecletica-1352	134	3	the	the	DET
ecletica-1352	134	4	goal	goal	NOUN
ecletica-1352	134	5	of	of	ADP
ecletica-1352	134	6	the	the	DET
ecletica-1352	134	7	in	in	ADP
ecletica-1352	134	8	-	-	PUNCT
ecletica-1352	134	9	silico	silico	NOUN
ecletica-1352	134	10	drug	drug	NOUN
ecletica-1352	134	11	discovery	discovery	NOUN
ecletica-1352	134	12	(	(	PUNCT
ecletica-1352	134	13	molecular	molecular	ADJ
ecletica-1352	134	14	docking	docking	NOUN
ecletica-1352	134	15	)	)	PUNCT
ecletica-1352	134	16	approach	approach	NOUN
ecletica-1352	134	17	is	be	AUX
ecletica-1352	134	18	to	to	PART
ecletica-1352	134	19	find	find	VERB
ecletica-1352	134	20	small	small	ADJ
ecletica-1352	134	21	molecules	molecule	NOUN
ecletica-1352	134	22	that	that	PRON
ecletica-1352	134	23	can	can	AUX
ecletica-1352	134	24	modulate	modulate	VERB
ecletica-1352	134	25	the	the	DET
ecletica-1352	134	26	function	function	NOUN
ecletica-1352	134	27	of	of	ADP
ecletica-1352	134	28	a	a	DET
ecletica-1352	134	29	target	target	NOUN
ecletica-1352	134	30	protein	protein	NOUN
ecletica-1352	134	31	,	,	PUNCT
ecletica-1352	134	32	which	which	PRON
ecletica-1352	134	33	is	be	AUX
ecletica-1352	134	34	a	a	DET
ecletica-1352	134	35	recessed	recessed	ADJ
ecletica-1352	134	36	portion	portion	NOUN
ecletica-1352	134	37	or	or	CCONJ
ecletica-1352	134	38	a	a	DET
ecletica-1352	134	39	slight	slight	ADJ
ecletica-1352	134	40	compartment	compartment	NOUN
ecletica-1352	134	41	of	of	ADP
ecletica-1352	134	42	a	a	DET
ecletica-1352	134	43	protein	protein	NOUN
ecletica-1352	134	44	where	where	SCONJ
ecletica-1352	134	45	a	a	DET
ecletica-1352	134	46	ligand	ligand	ADJ
ecletica-1352	134	47	molecule	molecule	NOUN
ecletica-1352	134	48	binds	bind	VERB
ecletica-1352	134	49	to	to	PART
ecletica-1352	134	50	yield	yield	VERB
ecletica-1352	134	51	the	the	DET
ecletica-1352	134	52	required	require	VERB
ecletica-1352	134	53	output	output	NOUN
ecletica-1352	134	54	(	(	PUNCT
ecletica-1352	134	55	i.e.	i.e.	X
ecletica-1352	134	56	,	,	PUNCT
ecletica-1352	134	57	activation	activation	NOUN
ecletica-1352	134	58	,	,	PUNCT
ecletica-1352	134	59	inhibition	inhibition	NOUN
ecletica-1352	134	60	,	,	PUNCT
ecletica-1352	134	61	or	or	CCONJ
ecletica-1352	134	62	modulation	modulation	NOUN
ecletica-1352	134	63	)	)	PUNCT
ecletica-1352	134	64	,	,	PUNCT
ecletica-1352	134	65	the	the	DET
ecletica-1352	134	66	binding	bind	VERB
ecletica-1352	134	67	site	site	NOUN
ecletica-1352	134	68	,	,	PUNCT
ecletica-1352	134	69	the	the	DET
ecletica-1352	134	70	right	right	ADJ
ecletica-1352	134	71	orientation	orientation	NOUN
ecletica-1352	134	72	,	,	PUNCT
ecletica-1352	134	73	and	and	CCONJ
ecletica-1352	134	74	the	the	DET
ecletica-1352	134	75	targeted	target	VERB
ecletica-1352	134	76	protein	protein	NOUN
ecletica-1352	134	77	ligand	ligand	NOUN
ecletica-1352	134	78	binding	bind	VERB
ecletica-1352	134	79	(	(	PUNCT
ecletica-1352	134	80	agwupuye	agwupuye	PROPN
ecletica-1352	134	81	et	et	PROPN
ecletica-1352	134	82	al	al	PROPN
ecletica-1352	134	83	.	.	PROPN
ecletica-1352	134	84	,	,	PUNCT
ecletica-1352	134	85	2021b	2021b	NUM
ecletica-1352	134	86	)	)	PUNCT
ecletica-1352	134	87	.	.	PUNCT
ecletica-1352	135	1	furthermore	furthermore	ADV
ecletica-1352	135	2	,	,	PUNCT
ecletica-1352	135	3	tiny	tiny	ADJ
ecletica-1352	135	4	compounds	compound	NOUN
ecletica-1352	135	5	with	with	ADP
ecletica-1352	135	6	useful	useful	ADJ
ecletica-1352	135	7	pharmacokinetics	pharmacokinetic	NOUN
ecletica-1352	135	8	and	and	CCONJ
ecletica-1352	135	9	pharmacodynamics	pharmacodynamic	NOUN
ecletica-1352	135	10	must	must	AUX
ecletica-1352	135	11	be	be	AUX
ecletica-1352	135	12	identified	identify	VERB
ecletica-1352	135	13	,	,	PUNCT
ecletica-1352	135	14	as	as	ADV
ecletica-1352	135	15	well	well	ADV
ecletica-1352	135	16	as	as	ADP
ecletica-1352	135	17	a	a	DET
ecletica-1352	135	18	series	series	NOUN
ecletica-1352	135	19	of	of	ADP
ecletica-1352	135	20	sophisticated	sophisticated	ADJ
ecletica-1352	135	21	stages	stage	NOUN
ecletica-1352	135	22	such	such	ADJ
ecletica-1352	135	23	as	as	ADP
ecletica-1352	135	24	drug	drug	NOUN
ecletica-1352	135	25	candidate	candidate	NOUN
ecletica-1352	135	26	discovery	discovery	NOUN
ecletica-1352	135	27	,	,	PUNCT
ecletica-1352	135	28	candidate	candidate	NOUN
ecletica-1352	135	29	validation	validation	NOUN
ecletica-1352	135	30	,	,	PUNCT
ecletica-1352	135	31	pharmacokinetics	pharmacokinetic	NOUN
ecletica-1352	135	32	,	,	PUNCT
ecletica-1352	135	33	and	and	CCONJ
ecletica-1352	135	34	preclinical	preclinical	ADJ
ecletica-1352	135	35	toxicity	toxicity	NOUN
ecletica-1352	135	36	evaluations	evaluation	NOUN
ecletica-1352	135	37	(	(	PUNCT
ecletica-1352	135	38	andrade	andrade	PROPN
ecletica-1352	135	39	et	et	PROPN
ecletica-1352	135	40	al	al	PROPN
ecletica-1352	135	41	.	.	PROPN
ecletica-1352	135	42	,	,	PUNCT
ecletica-1352	135	43	2016	2016	NUM
ecletica-1352	135	44	;	;	PUNCT
ecletica-1352	135	45	lavé	lavé	PROPN
ecletica-1352	135	46	et	et	PROPN
ecletica-1352	135	47	al	al	PROPN
ecletica-1352	135	48	.	.	PROPN
ecletica-1352	135	49	,	,	PUNCT
ecletica-1352	135	50	2007	2007	NUM
ecletica-1352	135	51	)	)	PUNCT
ecletica-1352	135	52	.	.	PUNCT
ecletica-1352	136	1	the	the	DET
ecletica-1352	136	2	title	title	NOUN
ecletica-1352	136	3	compound	compound	NOUN
ecletica-1352	136	4	being	be	AUX
ecletica-1352	136	5	an	an	DET
ecletica-1352	136	6	antimicrobial	antimicrobial	ADJ
ecletica-1352	136	7	drug	drug	NOUN
ecletica-1352	136	8	,	,	PUNCT
ecletica-1352	136	9	the	the	DET
ecletica-1352	136	10	antimicrobial	antimicrobial	ADJ
ecletica-1352	136	11	property	property	NOUN
ecletica-1352	136	12	of	of	ADP
ecletica-1352	136	13	the	the	DET
ecletica-1352	136	14	drug	drug	NOUN
ecletica-1352	136	15	is	be	AUX
ecletica-1352	136	16	investigated	investigate	VERB
ecletica-1352	136	17	further	far	ADV
ecletica-1352	136	18	by	by	ADP
ecletica-1352	136	19	docking	dock	VERB
ecletica-1352	136	20	the	the	DET
ecletica-1352	136	21	cd	cd	PROPN
ecletica-1352	136	22	mof	mof	NOUN
ecletica-1352	136	23	and	and	CCONJ
ecletica-1352	136	24	the	the	DET
ecletica-1352	136	25	standard	standard	ADJ
ecletica-1352	136	26	drug	drug	NOUN
ecletica-1352	136	27	levofloxacin	levofloxacin	NOUN
ecletica-1352	136	28	with	with	ADP
ecletica-1352	136	29	some	some	DET
ecletica-1352	136	30	selected	select	VERB
ecletica-1352	136	31	antimicrobial	antimicrobial	ADJ
ecletica-1352	136	32	proteins	protein	NOUN
ecletica-1352	136	33	1d7u	1d7u	NUM
ecletica-1352	136	34	and	and	CCONJ
ecletica-1352	136	35	2xcs	2xcs	NUM
ecletica-1352	136	36	.	.	PUNCT
ecletica-1352	137	1	the	the	DET
ecletica-1352	137	2	3d	3d	PROPN
ecletica-1352	137	3	crystallographic	crystallographic	ADJ
ecletica-1352	137	4	structures	structure	NOUN
ecletica-1352	137	5	of	of	ADP
ecletica-1352	137	6	the	the	DET
ecletica-1352	137	7	receptor	receptor	NOUN
ecletica-1352	137	8	molecules	molecule	NOUN
ecletica-1352	137	9	chosen	choose	VERB
ecletica-1352	137	10	for	for	ADP
ecletica-1352	137	11	docking	dock	VERB
ecletica-1352	137	12	studies	study	NOUN
ecletica-1352	137	13	were	be	AUX
ecletica-1352	137	14	prepared	prepare	VERB
ecletica-1352	137	15	by	by	ADP
ecletica-1352	137	16	removing	remove	VERB
ecletica-1352	137	17	water	water	NOUN
ecletica-1352	137	18	molecule	molecule	NOUN
ecletica-1352	137	19	,	,	PUNCT
ecletica-1352	137	20	adding	add	VERB
ecletica-1352	137	21	explicit	explicit	ADJ
ecletica-1352	137	22	hydrogens	hydrogen	NOUN
ecletica-1352	137	23	,	,	PUNCT
ecletica-1352	137	24	charges	charge	NOUN
ecletica-1352	137	25	,	,	PUNCT
ecletica-1352	137	26	and	and	CCONJ
ecletica-1352	137	27	correction	correction	NOUN
ecletica-1352	137	28	of	of	ADP
ecletica-1352	137	29	deformation	deformation	NOUN
ecletica-1352	137	30	in	in	ADP
ecletica-1352	137	31	amino	amino	NOUN
ecletica-1352	137	32	acid	acid	NOUN
ecletica-1352	137	33	sequence	sequence	NOUN
ecletica-1352	137	34	(	(	PUNCT
ecletica-1352	137	35	takaya	takaya	NOUN
ecletica-1352	137	36	et	et	PROPN
ecletica-1352	137	37	al	al	PROPN
ecletica-1352	137	38	.	.	PROPN
ecletica-1352	137	39	,	,	PUNCT
ecletica-1352	137	40	2020	2020	NUM
ecletica-1352	137	41	)	)	PUNCT
ecletica-1352	137	42	.	.	PUNCT
ecletica-1352	138	1	the	the	DET
ecletica-1352	138	2	active	active	ADJ
ecletica-1352	138	3	sites	site	NOUN
ecletica-1352	138	4	of	of	ADP
ecletica-1352	138	5	the	the	DET
ecletica-1352	138	6	receptor	receptor	NOUN
ecletica-1352	138	7	protein	protein	NOUN
ecletica-1352	138	8	were	be	AUX
ecletica-1352	138	9	predicted	predict	VERB
ecletica-1352	138	10	and	and	CCONJ
ecletica-1352	138	11	defined	define	VERB
ecletica-1352	138	12	based	base	VERB
ecletica-1352	138	13	on	on	ADP
ecletica-1352	138	14	the	the	DET
ecletica-1352	138	15	interaction	interaction	NOUN
ecletica-1352	138	16	of	of	ADP
ecletica-1352	138	17	the	the	DET
ecletica-1352	138	18	crystallographic	crystallographic	ADJ
ecletica-1352	138	19	ligand	ligand	NOUN
ecletica-1352	138	20	with	with	ADP
ecletica-1352	138	21	the	the	DET
ecletica-1352	138	22	receptor	receptor	NOUN
ecletica-1352	138	23	molecules	molecule	NOUN
ecletica-1352	138	24	respectively	respectively	ADV
ecletica-1352	138	25	as	as	SCONJ
ecletica-1352	138	26	visualized	visualize	VERB
ecletica-1352	138	27	with	with	ADP
ecletica-1352	138	28	the	the	DET
ecletica-1352	138	29	biovia	biovia	PROPN
ecletica-1352	138	30	discovery	discovery	PROPN
ecletica-1352	138	31	studio	studio	PROPN
ecletica-1352	138	32	visualizer	visualizer	NOUN
ecletica-1352	138	33	and	and	CCONJ
ecletica-1352	138	34	presented	present	VERB
ecletica-1352	138	35	in	in	ADP
ecletica-1352	138	36	fig	fig	NOUN
ecletica-1352	138	37	.	.	PUNCT
ecletica-1352	139	1	s1	s1	NOUN
ecletica-1352	139	2	and	and	CCONJ
ecletica-1352	139	3	s2	s2	PROPN
ecletica-1352	139	4	of	of	ADP
ecletica-1352	139	5	the	the	DET
ecletica-1352	139	6	supplementary	supplementary	ADJ
ecletica-1352	139	7	information	information	NOUN
ecletica-1352	139	8	(	(	PUNCT
ecletica-1352	139	9	kar	kar	NOUN
ecletica-1352	139	10	and	and	CCONJ
ecletica-1352	139	11	leszczynski	leszczynski	PROPN
ecletica-1352	139	12	,	,	PUNCT
ecletica-1352	139	13	2020	2020	NUM
ecletica-1352	139	14	)	)	PUNCT
ecletica-1352	139	15	.	.	PUNCT
ecletica-1352	140	1	the	the	DET
ecletica-1352	140	2	binding	bind	VERB
ecletica-1352	140	3	score	score	NOUN
ecletica-1352	140	4	of	of	ADP
ecletica-1352	140	5	the	the	DET
ecletica-1352	140	6	ligand	ligand	NOUN
ecletica-1352	140	7	docked	dock	VERB
ecletica-1352	140	8	with	with	ADP
ecletica-1352	140	9	the	the	DET
ecletica-1352	140	10	proteins	protein	NOUN
ecletica-1352	140	11	and	and	CCONJ
ecletica-1352	140	12	the	the	DET
ecletica-1352	140	13	standard	standard	ADJ
ecletica-1352	140	14	drug	drug	NOUN
ecletica-1352	140	15	is	be	AUX
ecletica-1352	140	16	presented	present	VERB
ecletica-1352	140	17	in	in	ADP
ecletica-1352	140	18	tab	tab	NOUN
ecletica-1352	140	19	.	.	PROPN
ecletica-1352	141	1	6	6	NUM
ecletica-1352	141	2	and	and	CCONJ
ecletica-1352	141	3	the	the	DET
ecletica-1352	141	4	average	average	ADJ
ecletica-1352	141	5	binding	bind	VERB
ecletica-1352	141	6	affinity	affinity	NOUN
ecletica-1352	141	7	has	have	AUX
ecletica-1352	141	8	been	be	AUX
ecletica-1352	141	9	generated	generate	VERB
ecletica-1352	141	10	based	base	VERB
ecletica-1352	141	11	on	on	ADP
ecletica-1352	141	12	the	the	DET
ecletica-1352	141	13	binding	bind	VERB
ecletica-1352	141	14	poses	pose	NOUN
ecletica-1352	141	15	generated	generate	VERB
ecletica-1352	141	16	.	.	PUNCT
ecletica-1352	142	1	from	from	ADP
ecletica-1352	142	2	the	the	DET
ecletica-1352	142	3	binding	bind	VERB
ecletica-1352	142	4	score	score	NOUN
ecletica-1352	142	5	obtained	obtain	VERB
ecletica-1352	142	6	from	from	ADP
ecletica-1352	142	7	the	the	DET
ecletica-1352	142	8	autodock	autodock	PROPN
ecletica-1352	142	9	vina	vina	PROPN
ecletica-1352	142	10	tool	tool	PROPN
ecletica-1352	142	11	,	,	PUNCT
ecletica-1352	142	12	the	the	DET
ecletica-1352	142	13	inhibitory	inhibitory	ADJ
ecletica-1352	142	14	action	action	NOUN
ecletica-1352	142	15	and	and	CCONJ
ecletica-1352	142	16	the	the	DET
ecletica-1352	142	17	binding	bind	VERB
ecletica-1352	142	18	strength	strength	NOUN
ecletica-1352	142	19	was	be	AUX
ecletica-1352	142	20	observed	observe	VERB
ecletica-1352	142	21	to	to	PART
ecletica-1352	142	22	be	be	AUX
ecletica-1352	142	23	in	in	ADP
ecletica-1352	142	24	the	the	DET
ecletica-1352	142	25	order	order	NOUN
ecletica-1352	142	26	2xcs_cd_complex	2xcs_cd_complex	NUM
ecletica-1352	142	27	>	>	SYM
ecletica-1352	142	28	1d7u_levofloxacin	1d7u_levofloxacin	NUM
ecletica-1352	142	29	and	and	CCONJ
ecletica-1352	142	30	1d7u_cd_complex	1d7u_cd_complex	NUM
ecletica-1352	142	31	>	>	X
ecletica-1352	142	32	1d7u_levofloxacin	1d7u_levofloxacin	NUM
ecletica-1352	142	33	.	.	PUNCT
ecletica-1352	143	1	the	the	DET
ecletica-1352	143	2	score	score	NOUN
ecletica-1352	143	3	and	and	CCONJ
ecletica-1352	143	4	the	the	DET
ecletica-1352	143	5	average	average	NOUN
ecletica-1352	143	6	are	be	AUX
ecletica-1352	143	7	presented	present	VERB
ecletica-1352	143	8	in	in	ADP
ecletica-1352	143	9	tab	tab	NOUN
ecletica-1352	143	10	.	.	PUNCT
ecletica-1352	144	1	7	7	X
ecletica-1352	144	2	.	.	X
ecletica-1352	144	3	interestingly	interestingly	ADV
ecletica-1352	144	4	,	,	PUNCT
ecletica-1352	144	5	hydrogen	hydrogen	NOUN
ecletica-1352	144	6	bond	bond	NOUN
ecletica-1352	144	7	interaction	interaction	NOUN
ecletica-1352	144	8	,	,	PUNCT
ecletica-1352	144	9	which	which	PRON
ecletica-1352	144	10	determines	determine	VERB
ecletica-1352	144	11	the	the	DET
ecletica-1352	144	12	activeness	activeness	NOUN
ecletica-1352	144	13	of	of	ADP
ecletica-1352	144	14	a	a	DET
ecletica-1352	144	15	potential	potential	ADJ
ecletica-1352	144	16	drug	drug	NOUN
ecletica-1352	144	17	candidate	candidate	NOUN
ecletica-1352	144	18	,	,	PUNCT
ecletica-1352	144	19	was	be	AUX
ecletica-1352	144	20	observed	observe	VERB
ecletica-1352	144	21	,	,	PUNCT
ecletica-1352	144	22	and	and	CCONJ
ecletica-1352	144	23	other	other	ADJ
ecletica-1352	144	24	interactions	interaction	NOUN
ecletica-1352	144	25	,	,	PUNCT
ecletica-1352	144	26	such	such	ADJ
ecletica-1352	144	27	as	as	ADP
ecletica-1352	144	28	steric	steric	ADJ
ecletica-1352	144	29	and	and	CCONJ
ecletica-1352	144	30	hydrophilic	hydrophilic	ADJ
ecletica-1352	144	31	,	,	PUNCT
ecletica-1352	144	32	were	be	AUX
ecletica-1352	144	33	carefully	carefully	ADV
ecletica-1352	144	34	studied	study	VERB
ecletica-1352	144	35	.	.	PUNCT
ecletica-1352	145	1	[	[	X
ecletica-1352	145	2	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	145	3	showed	show	VERB
ecletica-1352	145	4	its	its	PRON
ecletica-1352	145	5	hydrogen	hydrogen	NOUN
ecletica-1352	145	6	interactions	interaction	NOUN
ecletica-1352	145	7	with	with	ADP
ecletica-1352	145	8	the	the	DET
ecletica-1352	145	9	following	follow	VERB
ecletica-1352	145	10	amino	amino	ADJ
ecletica-1352	145	11	residue	residue	NOUN
ecletica-1352	145	12	when	when	SCONJ
ecletica-1352	145	13	docked	dock	VERB
ecletica-1352	145	14	with	with	ADP
ecletica-1352	145	15	1d7u	1d7u	NUM
ecletica-1352	145	16	which	which	PRON
ecletica-1352	145	17	were	be	AUX
ecletica-1352	145	18	ala	ala	PROPN
ecletica-1352	145	19	112	112	NUM
ecletica-1352	145	20	,	,	PUNCT
ecletica-1352	145	21	ala	ala	PROPN
ecletica-1352	145	22	245	245	NUM
ecletica-1352	145	23	,	,	PUNCT
ecletica-1352	145	24	arg	arg	NOUN
ecletica-1352	145	25	406	406	NUM
ecletica-1352	145	26	,	,	PUNCT
ecletica-1352	145	27	asn	asn	PROPN
ecletica-1352	145	28	115	115	NUM
ecletica-1352	145	29	,	,	PUNCT
ecletica-1352	145	30	asp	asp	PROPN
ecletica-1352	145	31	243	243	NUM
ecletica-1352	145	32	,	,	PUNCT
ecletica-1352	145	33	gln	gln	NOUN
ecletica-1352	145	34	52	52	NUM
ecletica-1352	145	35	,	,	PUNCT
ecletica-1352	145	36	gln	gln	NOUN
ecletica-1352	145	37	246	246	NUM
ecletica-1352	145	38	,	,	PUNCT
ecletica-1352	145	39	glu	glu	NOUN
ecletica-1352	145	40	210	210	NUM
ecletica-1352	145	41	,	,	PUNCT
ecletica-1352	145	42	glu	glu	NOUN
ecletica-1352	145	43	244	244	NUM
ecletica-1352	145	44	,	,	PUNCT
ecletica-1352	145	45	gly	gly	NOUN
ecletica-1352	145	46	111	111	NUM
ecletica-1352	145	47	,	,	PUNCT
ecletica-1352	145	48	gly	gly	NOUN
ecletica-1352	145	49	140	140	NUM
ecletica-1352	145	50	,	,	PUNCT
ecletica-1352	145	51	his	his	PRON
ecletica-1352	145	52	139	139	NUM
ecletica-1352	145	53	,	,	PUNCT
ecletica-1352	145	54	lys	lys	PROPN
ecletica-1352	145	55	272	272	NUM
ecletica-1352	145	56	,	,	PUNCT
ecletica-1352	145	57	met	meet	VERB
ecletica-1352	145	58	141	141	NUM
ecletica-1352	145	59	,	,	PUNCT
ecletica-1352	145	60	ser	ser	NOUN
ecletica-1352	145	61	214	214	NUM
ecletica-1352	145	62	,	,	PUNCT
ecletica-1352	145	63	ser	ser	NOUN
ecletica-1352	145	64	215	215	NUM
ecletica-1352	145	65	,	,	PUNCT
ecletica-1352	145	66	ser	ser	NOUN
ecletica-1352	145	67	271	271	NUM
ecletica-1352	145	68	,	,	PUNCT
ecletica-1352	145	69	and	and	CCONJ
ecletica-1352	145	70	trp	trp	PROPN
ecletica-1352	145	71	138	138	NUM
ecletica-1352	145	72	.	.	PUNCT
ecletica-1352	146	1	the	the	DET
ecletica-1352	146	2	standard	standard	PROPN
ecletica-1352	146	3	levofloxacin	levofloxacin	PROPN
ecletica-1352	146	4	displayed	display	VERB
ecletica-1352	146	5	the	the	DET
ecletica-1352	146	6	following	follow	VERB
ecletica-1352	146	7	inhibitors	inhibitor	NOUN
ecletica-1352	146	8	when	when	SCONJ
ecletica-1352	146	9	docked	dock	VERB
ecletica-1352	146	10	with	with	ADP
ecletica-1352	146	11	1d7u	1d7u	NUM
ecletica-1352	146	12	;	;	PUNCT
ecletica-1352	146	13	ala	ala	PROPN
ecletica-1352	146	14	112	112	NUM
ecletica-1352	146	15	,	,	PUNCT
ecletica-1352	146	16	ala	ala	PROPN
ecletica-1352	146	17	245	245	NUM
ecletica-1352	146	18	,	,	PUNCT
ecletica-1352	146	19	arg	arg	NOUN
ecletica-1352	146	20	406	406	NUM
ecletica-1352	146	21	,	,	PUNCT
ecletica-1352	146	22	asn	asn	PROPN
ecletica-1352	146	23	115	115	NUM
ecletica-1352	146	24	,	,	PUNCT
ecletica-1352	146	25	asp	asp	PROPN
ecletica-1352	146	26	243	243	NUM
ecletica-1352	146	27	,	,	PUNCT
ecletica-1352	146	28	gln	gln	NOUN
ecletica-1352	146	29	52	52	NUM
ecletica-1352	146	30	,	,	PUNCT
ecletica-1352	146	31	gln	gln	NOUN
ecletica-1352	146	32	246	246	NUM
ecletica-1352	146	33	,	,	PUNCT
ecletica-1352	146	34	glu	glu	NOUN
ecletica-1352	146	35	210	210	NUM
ecletica-1352	146	36	,	,	PUNCT
ecletica-1352	146	37	glu	glu	NOUN
ecletica-1352	146	38	244	244	NUM
ecletica-1352	146	39	,	,	PUNCT
ecletica-1352	146	40	gly	gly	NOUN
ecletica-1352	146	41	111	111	NUM
ecletica-1352	146	42	,	,	PUNCT
ecletica-1352	146	43	gly	gly	NOUN
ecletica-1352	146	44	140	140	NUM
ecletica-1352	146	45	,	,	PUNCT
ecletica-1352	146	46	his	his	PRON
ecletica-1352	146	47	139	139	NUM
ecletica-1352	146	48	,	,	PUNCT
ecletica-1352	146	49	lys	lys	PROPN
ecletica-1352	146	50	272	272	NUM
ecletica-1352	146	51	,	,	PUNCT
ecletica-1352	146	52	met	meet	VERB
ecletica-1352	146	53	141	141	NUM
ecletica-1352	146	54	,	,	PUNCT
ecletica-1352	146	55	ser	ser	NOUN
ecletica-1352	146	56	214	214	NUM
ecletica-1352	146	57	,	,	PUNCT
ecletica-1352	146	58	ser	ser	NOUN
ecletica-1352	146	59	215	215	NUM
ecletica-1352	146	60	,	,	PUNCT
ecletica-1352	146	61	ser	ser	NOUN
ecletica-1352	146	62	271	271	NUM
ecletica-1352	146	63	,	,	PUNCT
ecletica-1352	146	64	trp	trp	PROPN
ecletica-1352	146	65	138	138	NUM
ecletica-1352	146	66	,	,	PUNCT
ecletica-1352	146	67	and	and	CCONJ
ecletica-1352	146	68	tyr	tyr	NOUN
ecletica-1352	146	69	:	:	PUNCT
ecletica-1352	146	70	20	20	NUM
ecletica-1352	146	71	.	.	PUNCT
ecletica-1352	147	1	moreover	moreover	ADV
ecletica-1352	147	2	,	,	PUNCT
ecletica-1352	147	3	11	11	NUM
ecletica-1352	147	4	interactions	interaction	NOUN
ecletica-1352	147	5	other	other	ADJ
ecletica-1352	147	6	than	than	ADP
ecletica-1352	147	7	hydrogen	hydrogen	NOUN
ecletica-1352	147	8	occurred	occur	VERB
ecletica-1352	147	9	between	between	ADP
ecletica-1352	147	10	the	the	DET
ecletica-1352	147	11	1d7u	1d7u	ADJ
ecletica-1352	147	12	protein	protein	NOUN
ecletica-1352	147	13	binding	bind	VERB
ecletica-1352	147	14	site	site	NOUN
ecletica-1352	147	15	with	with	ADP
ecletica-1352	147	16	the	the	DET
ecletica-1352	147	17	[	[	X
ecletica-1352	147	18	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	147	19	,	,	PUNCT
ecletica-1352	147	20	which	which	PRON
ecletica-1352	147	21	were	be	AUX
ecletica-1352	147	22	ala	ala	PROPN
ecletica-1352	147	23	152	152	NUM
ecletica-1352	147	24	,	,	PUNCT
ecletica-1352	147	25	asn	asn	PROPN
ecletica-1352	147	26	394	394	NUM
ecletica-1352	147	27	,	,	PUNCT
ecletica-1352	147	28	gln	gln	NOUN
ecletica-1352	147	29	397	397	NUM
ecletica-1352	147	30	,	,	PUNCT
ecletica-1352	147	31	ile	ile	NOUN
ecletica-1352	147	32	212	212	NUM
ecletica-1352	147	33	,	,	PUNCT
ecletica-1352	147	34	ile	ile	PROPN
ecletica-1352	147	35	395	395	NUM
ecletica-1352	147	36	,	,	PUNCT
ecletica-1352	147	37	leu	leu	PROPN
ecletica-1352	147	38	398	398	NUM
ecletica-1352	147	39	,	,	PUNCT
ecletica-1352	147	40	met	meet	VERB
ecletica-1352	147	41	53	53	NUM
ecletica-1352	147	42	,	,	PUNCT
ecletica-1352	147	43	ser	ser	NOUN
ecletica-1352	147	44	54	54	NUM
ecletica-1352	147	45	,	,	PUNCT
ecletica-1352	147	46	ser	ser	NOUN
ecletica-1352	147	47	151	151	NUM
ecletica-1352	147	48	,	,	PUNCT
ecletica-1352	147	49	thr	thr	PROPN
ecletica-1352	147	50	110	110	NUM
ecletica-1352	147	51	,	,	PUNCT
ecletica-1352	147	52	and	and	CCONJ
ecletica-1352	147	53	var	var	NOUN
ecletica-1352	147	54	396	396	NUM
ecletica-1352	147	55	.	.	PUNCT
ecletica-1352	148	1	it	it	PRON
ecletica-1352	148	2	is	be	AUX
ecletica-1352	148	3	worthy	worthy	ADJ
ecletica-1352	148	4	to	to	PART
ecletica-1352	148	5	note	note	VERB
ecletica-1352	148	6	that	that	SCONJ
ecletica-1352	148	7	the	the	DET
ecletica-1352	148	8	only	only	ADJ
ecletica-1352	148	9	target	target	NOUN
ecletica-1352	148	10	molecule	molecule	NOUN
ecletica-1352	148	11	residue	residue	NOUN
ecletica-1352	148	12	found	find	VERB
ecletica-1352	148	13	in	in	ADP
ecletica-1352	148	14	standard	standard	ADJ
ecletica-1352	148	15	levofloxacin	levofloxacin	NOUN
ecletica-1352	148	16	and	and	CCONJ
ecletica-1352	148	17	not	not	PART
ecletica-1352	148	18	found	find	VERB
ecletica-1352	148	19	in	in	ADP
ecletica-1352	148	20	[	[	PUNCT
ecletica-1352	148	21	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	148	22	is	be	AUX
ecletica-1352	148	23	tyr	tyr	PROPN
ecletica-1352	148	24	20	20	NUM
ecletica-1352	148	25	.	.	PUNCT
ecletica-1352	149	1	the	the	DET
ecletica-1352	149	2	standard	standard	PROPN
ecletica-1352	149	3	levofloxacin	levofloxacin	PROPN
ecletica-1352	149	4	inhibitor	inhibitor	NOUN
ecletica-1352	149	5	showed	show	VERB
ecletica-1352	149	6	4	4	NUM
ecletica-1352	149	7	hydrogen	hydrogen	NOUN
ecletica-1352	149	8	interactions	interaction	NOUN
ecletica-1352	149	9	for	for	ADP
ecletica-1352	149	10	protein	protein	NOUN
ecletica-1352	149	11	–	–	PUNCT
ecletica-1352	149	12	ligand	ligand	NOUN
ecletica-1352	149	13	interactions	interaction	NOUN
ecletica-1352	149	14	:	:	PUNCT
ecletica-1352	149	15	2	2	NUM
ecletica-1352	149	16	donors	donor	NOUN
ecletica-1352	149	17	from	from	ADP
ecletica-1352	149	18	target	target	NOUN
ecletica-1352	149	19	protein	protein	NOUN
ecletica-1352	149	20	gln	gln	NOUN
ecletica-1352	149	21	246	246	NUM
ecletica-1352	149	22	,	,	PUNCT
ecletica-1352	149	23	and	and	CCONJ
ecletica-1352	149	24	2	2	NUM
ecletica-1352	149	25	donors	donor	NOUN
ecletica-1352	149	26	from	from	ADP
ecletica-1352	149	27	ligand	ligand	NOUN
ecletica-1352	149	28	(	(	PUNCT
ecletica-1352	149	29	from	from	ADP
ecletica-1352	149	30	oxygen	oxygen	NOUN
ecletica-1352	149	31	atom	atom	NOUN
ecletica-1352	149	32	in	in	ADP
ecletica-1352	149	33	ligand	ligand	NOUN
ecletica-1352	149	34	to	to	PART
ecletica-1352	149	35	residue	residue	NOUN
ecletica-1352	149	36	trp	trp	PROPN
ecletica-1352	149	37	138	138	NUM
ecletica-1352	149	38	)	)	PUNCT
ecletica-1352	149	39	,	,	PUNCT
ecletica-1352	149	40	having	have	VERB
ecletica-1352	149	41	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	149	42	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	149	43	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	PROPN
ecletica-1352	149	44	original	original	ADJ
ecletica-1352	149	45	article	article	NOUN
ecletica-1352	149	46	revista.iq.unesp.br	revista.iq.unesp.br	X
ecletica-1352	149	47	44	44	NUM
ecletica-1352	149	48	eclética	eclética	PROPN
ecletica-1352	149	49	química	química	PROPN
ecletica-1352	149	50	journal	journal	PROPN
ecletica-1352	149	51	,	,	PUNCT
ecletica-1352	149	52	vol	vol	NOUN
ecletica-1352	149	53	.	.	PROPN
ecletica-1352	150	1	47	47	NUM
ecletica-1352	150	2	,	,	PUNCT
ecletica-1352	150	3	n.	n.	NOUN
ecletica-1352	150	4	4	4	NUM
ecletica-1352	150	5	,	,	PUNCT
ecletica-1352	150	6	2022	2022	NUM
ecletica-1352	150	7	,	,	PUNCT
ecletica-1352	150	8	37	37	NUM
ecletica-1352	150	9	-	-	SYM
ecletica-1352	150	10	50	50	NUM
ecletica-1352	150	11	issn	issn	NOUN
ecletica-1352	150	12	:	:	PUNCT
ecletica-1352	150	13	1678	1678	NUM
ecletica-1352	150	14	-	-	SYM
ecletica-1352	150	15	4618	4618	NUM
ecletica-1352	150	16	doi	doi	NOUN
ecletica-1352	150	17	:	:	PUNCT
ecletica-1352	150	18	10.26850/1678	10.26850/1678	NUM
ecletica-1352	150	19	-	-	PUNCT
ecletica-1352	150	20	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	150	21	-	-	PUNCT
ecletica-1352	150	22	50	50	NUM
ecletica-1352	150	23	bond	bond	NOUN
ecletica-1352	150	24	lengths	length	NOUN
ecletica-1352	150	25	ranging	range	VERB
ecletica-1352	150	26	from	from	ADP
ecletica-1352	150	27	2.5–3.2	2.5–3.2	NOUN
ecletica-1352	150	28	å	å	X
ecletica-1352	150	29	.	.	PUNCT
ecletica-1352	151	1	however	however	ADV
ecletica-1352	151	2	,	,	PUNCT
ecletica-1352	151	3	[	[	X
ecletica-1352	151	4	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	151	5	showed	show	VERB
ecletica-1352	151	6	24	24	NUM
ecletica-1352	151	7	hydrogen	hydrogen	NOUN
ecletica-1352	151	8	interactions	interaction	NOUN
ecletica-1352	151	9	:	:	PUNCT
ecletica-1352	151	10	17	17	NUM
ecletica-1352	151	11	donors	donor	NOUN
ecletica-1352	151	12	from	from	ADP
ecletica-1352	151	13	target	target	NOUN
ecletica-1352	151	14	,	,	PUNCT
ecletica-1352	151	15	5	5	NUM
ecletica-1352	151	16	donors	donor	NOUN
ecletica-1352	151	17	from	from	ADP
ecletica-1352	151	18	ligand	ligand	NOUN
ecletica-1352	151	19	,	,	PUNCT
ecletica-1352	151	20	and	and	CCONJ
ecletica-1352	151	21	2	2	NUM
ecletica-1352	151	22	donors	donor	NOUN
ecletica-1352	151	23	from	from	ADP
ecletica-1352	151	24	either	either	CCONJ
ecletica-1352	151	25	target	target	NOUN
ecletica-1352	151	26	or	or	CCONJ
ecletica-1352	151	27	ligand	ligand	NOUN
ecletica-1352	151	28	.	.	PUNCT
ecletica-1352	152	1	the	the	DET
ecletica-1352	152	2	bond	bond	NOUN
ecletica-1352	152	3	length	length	NOUN
ecletica-1352	152	4	ranges	range	VERB
ecletica-1352	152	5	from	from	ADP
ecletica-1352	152	6	1.6–3.5	1.6–3.5	NUM
ecletica-1352	152	7	å	å	NOUN
ecletica-1352	152	8	.	.	PUNCT
ecletica-1352	153	1	hydrogen	hydrogen	NOUN
ecletica-1352	153	2	bonds	bond	NOUN
ecletica-1352	153	3	in	in	ADP
ecletica-1352	153	4	protein	protein	NOUN
ecletica-1352	153	5	-	-	PUNCT
ecletica-1352	153	6	ligand	ligand	NOUN
ecletica-1352	153	7	interactions	interaction	NOUN
ecletica-1352	153	8	are	be	AUX
ecletica-1352	153	9	vital	vital	ADJ
ecletica-1352	153	10	determinants	determinant	NOUN
ecletica-1352	153	11	for	for	ADP
ecletica-1352	153	12	ligand	ligand	ADJ
ecletica-1352	153	13	binding	bind	VERB
ecletica-1352	153	14	affinity	affinity	NOUN
ecletica-1352	153	15	.	.	PUNCT
ecletica-1352	154	1	the	the	PRON
ecletica-1352	154	2	[	[	X
ecletica-1352	154	3	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	154	4	also	also	ADV
ecletica-1352	154	5	showed	show	VERB
ecletica-1352	154	6	some	some	DET
ecletica-1352	154	7	interactions	interaction	NOUN
ecletica-1352	154	8	with	with	ADP
ecletica-1352	154	9	protein	protein	NOUN
ecletica-1352	154	10	2xcs	2xcs	PROPN
ecletica-1352	154	11	which	which	PRON
ecletica-1352	154	12	were	be	AUX
ecletica-1352	154	13	2xcs[b	2xcs[b	NUM
ecletica-1352	154	14	]	]	PUNCT
ecletica-1352	154	15	:	:	PUNCT
ecletica-1352	154	16	arg	arg	NOUN
ecletica-1352	154	17	1069	1069	NUM
ecletica-1352	154	18	,	,	PUNCT
ecletica-1352	154	19	asp	asp	NOUN
ecletica-1352	154	20	1073	1073	NUM
ecletica-1352	154	21	,	,	PUNCT
ecletica-1352	154	22	gln	gln	PROPN
ecletica-1352	154	23	1056	1056	NUM
ecletica-1352	154	24	,	,	PUNCT
ecletica-1352	154	25	gly	gly	NOUN
ecletica-1352	154	26	1072	1072	NUM
ecletica-1352	154	27	,	,	PUNCT
ecletica-1352	154	28	lys	lys	PROPN
ecletica-1352	154	29	1065	1065	NUM
ecletica-1352	154	30	,	,	PUNCT
ecletica-1352	154	31	met	meet	VERB
ecletica-1352	154	32	1058	1058	NUM
ecletica-1352	154	33	,	,	PUNCT
ecletica-1352	154	34	2xcs[d	2xcs[d	NUM
ecletica-1352	154	35	]	]	PUNCT
ecletica-1352	154	36	:	:	PUNCT
ecletica-1352	154	37	arg	arg	NOUN
ecletica-1352	154	38	1069	1069	NUM
ecletica-1352	154	39	,	,	PUNCT
ecletica-1352	154	40	asp	asp	NOUN
ecletica-1352	154	41	1073	1073	NUM
ecletica-1352	154	42	,	,	PUNCT
ecletica-1352	154	43	and	and	CCONJ
ecletica-1352	154	44	gly	gly	ADJ
ecletica-1352	154	45	1072	1072	NUM
ecletica-1352	154	46	.	.	PUNCT
ecletica-1352	155	1	the	the	DET
ecletica-1352	155	2	standard	standard	PROPN
ecletica-1352	155	3	levofloxacin	levofloxacin	PROPN
ecletica-1352	155	4	inhibitor	inhibitor	NOUN
ecletica-1352	155	5	involves	involve	VERB
ecletica-1352	155	6	complex	complex	ADJ
ecletica-1352	155	7	interaction	interaction	NOUN
ecletica-1352	155	8	with	with	ADP
ecletica-1352	155	9	15	15	NUM
ecletica-1352	155	10	active	active	ADJ
ecletica-1352	155	11	interaction	interaction	NOUN
ecletica-1352	155	12	sites	site	NOUN
ecletica-1352	155	13	of	of	ADP
ecletica-1352	155	14	protein	protein	NOUN
ecletica-1352	155	15	2xcs	2xcs	PROPN
ecletica-1352	155	16	,	,	PUNCT
ecletica-1352	155	17	which	which	PRON
ecletica-1352	155	18	were	be	AUX
ecletica-1352	155	19	arg	arg	NOUN
ecletica-1352	155	20	1069	1069	NUM
ecletica-1352	155	21	,	,	PUNCT
ecletica-1352	155	22	asp	asp	NOUN
ecletica-1352	155	23	1073	1073	NUM
ecletica-1352	155	24	,	,	PUNCT
ecletica-1352	155	25	gln	gln	PROPN
ecletica-1352	155	26	1056	1056	NUM
ecletica-1352	155	27	,	,	PUNCT
ecletica-1352	155	28	gly	gly	NOUN
ecletica-1352	155	29	1072	1072	NUM
ecletica-1352	155	30	,	,	PUNCT
ecletica-1352	155	31	lys	lys	PROPN
ecletica-1352	155	32	1065	1065	NUM
ecletica-1352	155	33	,	,	PUNCT
ecletica-1352	155	34	met	meet	VERB
ecletica-1352	155	35	1058	1058	NUM
ecletica-1352	155	36	,	,	PUNCT
ecletica-1352	155	37	2xcs[d	2xcs[d	NUM
ecletica-1352	155	38	]	]	X
ecletica-1352	155	39	ala	ala	PROPN
ecletica-1352	155	40	1068	1068	NUM
ecletica-1352	155	41	,	,	PUNCT
ecletica-1352	155	42	arg	arg	NOUN
ecletica-1352	155	43	1069	1069	NUM
ecletica-1352	155	44	,	,	PUNCT
ecletica-1352	155	45	asp	asp	NOUN
ecletica-1352	155	46	1073	1073	NUM
ecletica-1352	155	47	,	,	PUNCT
ecletica-1352	155	48	gln	gln	PROPN
ecletica-1352	155	49	1056	1056	NUM
ecletica-1352	155	50	,	,	PUNCT
ecletica-1352	155	51	gly	gly	NOUN
ecletica-1352	155	52	1072	1072	NUM
ecletica-1352	155	53	,	,	PUNCT
ecletica-1352	155	54	ile	ile	PROPN
ecletica-1352	155	55	1070	1070	NUM
ecletica-1352	155	56	,	,	PUNCT
ecletica-1352	155	57	lys	lys	PROPN
ecletica-1352	155	58	1065	1065	NUM
ecletica-1352	155	59	,	,	PUNCT
ecletica-1352	155	60	lys	lys	PROPN
ecletica-1352	155	61	1066	1066	NUM
ecletica-1352	155	62	,	,	PUNCT
ecletica-1352	155	63	and	and	CCONJ
ecletica-1352	155	64	met	meet	VERB
ecletica-1352	155	65	1058	1058	NUM
ecletica-1352	155	66	.	.	PUNCT
ecletica-1352	156	1	it	it	PRON
ecletica-1352	156	2	is	be	AUX
ecletica-1352	156	3	worthy	worthy	ADJ
ecletica-1352	156	4	to	to	PART
ecletica-1352	156	5	note	note	VERB
ecletica-1352	156	6	that	that	SCONJ
ecletica-1352	156	7	all	all	DET
ecletica-1352	156	8	interactions	interaction	NOUN
ecletica-1352	156	9	with	with	ADP
ecletica-1352	156	10	the	the	DET
ecletica-1352	156	11	protein	protein	NOUN
ecletica-1352	156	12	2xcs[b	2xcs[b	NOUN
ecletica-1352	156	13	]	]	PUNCT
ecletica-1352	156	14	for	for	ADP
ecletica-1352	156	15	levofloxacin	levofloxacin	PROPN
ecletica-1352	156	16	and	and	CCONJ
ecletica-1352	156	17	[	[	X
ecletica-1352	156	18	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	156	19	have	have	VERB
ecletica-1352	156	20	the	the	DET
ecletica-1352	156	21	same	same	ADJ
ecletica-1352	156	22	number	number	NOUN
ecletica-1352	156	23	of	of	ADP
ecletica-1352	156	24	residues	residue	NOUN
ecletica-1352	156	25	i	i	PRON
ecletica-1352	156	26	d.	d.	VERB
ecletica-1352	156	27	however	however	ADV
ecletica-1352	156	28	,	,	PUNCT
ecletica-1352	156	29	11	11	NUM
ecletica-1352	156	30	more	more	ADJ
ecletica-1352	156	31	interactions	interaction	NOUN
ecletica-1352	156	32	occurred	occur	VERB
ecletica-1352	156	33	between	between	ADP
ecletica-1352	156	34	the	the	DET
ecletica-1352	156	35	2xcs	2xcs	NUM
ecletica-1352	156	36	protein	protein	NOUN
ecletica-1352	156	37	binding	bind	VERB
ecletica-1352	156	38	site	site	NOUN
ecletica-1352	156	39	with	with	ADP
ecletica-1352	156	40	the	the	DET
ecletica-1352	156	41	[	[	X
ecletica-1352	156	42	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	156	43	,	,	PUNCT
ecletica-1352	156	44	which	which	PRON
ecletica-1352	156	45	were	be	AUX
ecletica-1352	156	46	2xcs[b	2xcs[b	NUM
ecletica-1352	156	47	]	]	NOUN
ecletica-1352	156	48	:	:	PUNCT
ecletica-1352	156	49	gly	gly	NOUN
ecletica-1352	156	50	1052	1052	NUM
ecletica-1352	156	51	,	,	PUNCT
ecletica-1352	156	52	ile	ile	PROPN
ecletica-1352	156	53	1070	1070	NUM
ecletica-1352	156	54	,	,	PUNCT
ecletica-1352	156	55	leu	leu	PROPN
ecletica-1352	156	56	1053	1053	NUM
ecletica-1352	156	57	,	,	PUNCT
ecletica-1352	156	58	lys	lys	PROPN
ecletica-1352	156	59	1066	1066	NUM
ecletica-1352	156	60	,	,	PUNCT
ecletica-1352	156	61	ser	ser	NOUN
ecletica-1352	156	62	1063	1063	NUM
ecletica-1352	156	63	,	,	PUNCT
ecletica-1352	156	64	tyr	tyr	PROPN
ecletica-1352	156	65	1064	1064	NUM
ecletica-1352	156	66	,	,	PUNCT
ecletica-1352	156	67	val	val	NOUN
ecletica-1352	156	68	1074	1074	NUM
ecletica-1352	156	69	,	,	PUNCT
ecletica-1352	156	70	2xcs[d	2xcs[d	NUM
ecletica-1352	156	71	]	]	PUNCT
ecletica-1352	156	72	:	:	PUNCT
ecletica-1352	156	73	asn	asn	PROPN
ecletica-1352	156	74	1153	1153	NUM
ecletica-1352	156	75	,	,	PUNCT
ecletica-1352	156	76	asp	asp	NOUN
ecletica-1352	156	77	1151	1151	NUM
ecletica-1352	156	78	,	,	PUNCT
ecletica-1352	156	79	glu	glu	NOUN
ecletica-1352	156	80	1154	1154	NUM
ecletica-1352	156	81	,	,	PUNCT
ecletica-1352	156	82	and	and	CCONJ
ecletica-1352	156	83	lys	lys	PROPN
ecletica-1352	156	84	1077	1077	NUM
ecletica-1352	156	85	.	.	PUNCT
ecletica-1352	157	1	the	the	DET
ecletica-1352	157	2	epair	epair	NOUN
ecletica-1352	157	3	energy	energy	NOUN
ecletica-1352	157	4	for	for	ADP
ecletica-1352	157	5	levofloxacin	levofloxacin	NOUN
ecletica-1352	157	6	and	and	CCONJ
ecletica-1352	157	7	[	[	X
ecletica-1352	157	8	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	157	9	is	be	AUX
ecletica-1352	157	10	strongest	strong	ADJ
ecletica-1352	157	11	for	for	ADP
ecletica-1352	157	12	residue	residue	NOUN
ecletica-1352	157	13	2xcs[d	2xcs[d	NUM
ecletica-1352	157	14	]	]	X
ecletica-1352	157	15	arg	arg	NOUN
ecletica-1352	157	16	1069	1069	NUM
ecletica-1352	157	17	(	(	PUNCT
ecletica-1352	157	18	–	–	PUNCT
ecletica-1352	157	19	28.3235	28.3235	NUM
ecletica-1352	157	20	)	)	PUNCT
ecletica-1352	157	21	and	and	CCONJ
ecletica-1352	157	22	2xcs[b	2xcs[b	NUM
ecletica-1352	157	23	]	]	X
ecletica-1352	157	24	arg	arg	NOUN
ecletica-1352	157	25	1069	1069	NUM
ecletica-1352	157	26	(	(	PUNCT
ecletica-1352	157	27	–	–	PUNCT
ecletica-1352	157	28	36.9925	36.9925	NUM
ecletica-1352	157	29	)	)	PUNCT
ecletica-1352	157	30	respectively	respectively	ADV
ecletica-1352	157	31	.	.	PUNCT
ecletica-1352	157	32	table	table	NOUN
ecletica-1352	157	33	7	7	NUM
ecletica-1352	157	34	.	.	PUNCT
ecletica-1352	158	1	the	the	DET
ecletica-1352	158	2	binding	bind	VERB
ecletica-1352	158	3	affinity	affinity	NOUN
ecletica-1352	158	4	values	value	NOUN
ecletica-1352	158	5	of	of	ADP
ecletica-1352	158	6	different	different	ADJ
ecletica-1352	158	7	poses	pose	NOUN
ecletica-1352	158	8	of	of	ADP
ecletica-1352	158	9	the	the	DET
ecletica-1352	158	10	cd	cd	PROPN
ecletica-1352	158	11	_	_	PROPN
ecletica-1352	158	12	complex	complex	ADJ
ecletica-1352	158	13	and	and	CCONJ
ecletica-1352	158	14	levofloxacin	levofloxacin	NOUN
ecletica-1352	158	15	with	with	ADP
ecletica-1352	158	16	the	the	DET
ecletica-1352	158	17	receptor	receptor	NOUN
ecletica-1352	158	18	protein	protein	NOUN
ecletica-1352	158	19	1d7u	1d7u	PROPN
ecletica-1352	158	20	and	and	CCONJ
ecletica-1352	158	21	2xcs	2xcs	NUM
ecletica-1352	158	22	predicted	predict	VERB
ecletica-1352	158	23	at	at	ADP
ecletica-1352	158	24	auto	auto	NOUN
ecletica-1352	158	25	-	-	PUNCT
ecletica-1352	158	26	dock	dock	NOUN
ecletica-1352	158	27	vina	vina	PROPN
ecletica-1352	158	28	tool	tool	PROPN
ecletica-1352	158	29	.	.	PUNCT
ecletica-1352	159	1	modes	mode	NOUN
ecletica-1352	159	2	1d7u_[cd(btc)(h2o)2]n	1d7u_[cd(btc)(h2o)2]n	NUM
ecletica-1352	159	3	(	(	PUNCT
ecletica-1352	159	4	kcal	kcal	X
ecletica-1352	159	5	mol–1	mol–1	NOUN
ecletica-1352	159	6	)	)	PUNCT
ecletica-1352	159	7	1d7u_levofloxacin	1d7u_levofloxacin	NUM
ecletica-1352	159	8	(	(	PUNCT
ecletica-1352	159	9	kcal	kcal	X
ecletica-1352	159	10	mol–1	mol–1	NOUN
ecletica-1352	159	11	)	)	PUNCT
ecletica-1352	159	12	2xcs_[cd(btc)(h2o)2]n	2xcs_[cd(btc)(h2o)2]n	NOUN
ecletica-1352	159	13	(	(	PUNCT
ecletica-1352	159	14	kcal	kcal	X
ecletica-1352	159	15	mol–1	mol–1	NOUN
ecletica-1352	159	16	)	)	PUNCT
ecletica-1352	159	17	1d7u_levofloxacin	1d7u_levofloxacin	NUM
ecletica-1352	159	18	(	(	PUNCT
ecletica-1352	159	19	kcal	kcal	X
ecletica-1352	159	20	mol–1	mol–1	NOUN
ecletica-1352	159	21	)	)	PUNCT
ecletica-1352	159	22	1	1	NUM
ecletica-1352	159	23	–	–	PUNCT
ecletica-1352	159	24	7.0	7.0	NUM
ecletica-1352	159	25	–	–	PUNCT
ecletica-1352	159	26	7.2	7.2	NUM
ecletica-1352	159	27	–	–	PUNCT
ecletica-1352	159	28	11.5	11.5	NUM
ecletica-1352	159	29	–	–	SYM
ecletica-1352	159	30	9.3	9.3	NUM
ecletica-1352	159	31	2	2	NUM
ecletica-1352	159	32	–	–	PUNCT
ecletica-1352	159	33	6.7	6.7	NUM
ecletica-1352	159	34	–	–	SYM
ecletica-1352	159	35	6.8	6.8	NUM
ecletica-1352	159	36	–	–	PUNCT
ecletica-1352	159	37	11.2	11.2	NUM
ecletica-1352	159	38	–	–	PUNCT
ecletica-1352	159	39	9.1	9.1	NUM
ecletica-1352	159	40	3	3	NUM
ecletica-1352	159	41	–	–	PUNCT
ecletica-1352	159	42	6.6	6.6	NUM
ecletica-1352	159	43	–	–	PUNCT
ecletica-1352	159	44	6.5	6.5	NUM
ecletica-1352	159	45	–	–	SYM
ecletica-1352	159	46	11.2	11.2	NUM
ecletica-1352	159	47	–	–	PUNCT
ecletica-1352	159	48	9.1	9.1	NUM
ecletica-1352	159	49	4	4	NUM
ecletica-1352	159	50	–	–	PUNCT
ecletica-1352	159	51	6.6	6.6	NUM
ecletica-1352	159	52	–	–	PUNCT
ecletica-1352	159	53	6.2	6.2	NUM
ecletica-1352	159	54	–	–	SYM
ecletica-1352	159	55	11.2	11.2	NUM
ecletica-1352	159	56	–	–	PUNCT
ecletica-1352	159	57	9.0	9.0	NUM
ecletica-1352	159	58	5	5	NUM
ecletica-1352	159	59	–	–	PUNCT
ecletica-1352	159	60	6.6	6.6	NUM
ecletica-1352	159	61	–	–	PUNCT
ecletica-1352	159	62	6.2	6.2	NUM
ecletica-1352	159	63	–	–	PUNCT
ecletica-1352	159	64	11.1	11.1	NUM
ecletica-1352	159	65	–	–	PUNCT
ecletica-1352	159	66	9.0	9.0	NUM
ecletica-1352	159	67	6	6	NUM
ecletica-1352	159	68	–	–	PUNCT
ecletica-1352	159	69	6.6	6.6	NUM
ecletica-1352	159	70	–	–	PUNCT
ecletica-1352	159	71	6.1	6.1	NUM
ecletica-1352	159	72	–	–	PUNCT
ecletica-1352	159	73	11.1	11.1	NUM
ecletica-1352	159	74	–	–	PUNCT
ecletica-1352	159	75	8.9	8.9	NUM
ecletica-1352	159	76	7	7	NUM
ecletica-1352	159	77	–	–	PUNCT
ecletica-1352	159	78	6.6	6.6	NUM
ecletica-1352	159	79	–	–	PUNCT
ecletica-1352	159	80	6.1	6.1	NUM
ecletica-1352	159	81	–	–	PUNCT
ecletica-1352	159	82	11.1	11.1	NUM
ecletica-1352	159	83	–	–	PUNCT
ecletica-1352	159	84	8.9	8.9	NUM
ecletica-1352	159	85	8	8	NUM
ecletica-1352	159	86	–	–	PUNCT
ecletica-1352	159	87	6.5	6.5	NUM
ecletica-1352	159	88	–	–	SYM
ecletica-1352	159	89	5.9	5.9	NUM
ecletica-1352	159	90	–	–	SYM
ecletica-1352	159	91	11.1	11.1	NUM
ecletica-1352	159	92	–	–	PUNCT
ecletica-1352	159	93	8.9	8.9	NUM
ecletica-1352	159	94	9	9	NUM
ecletica-1352	159	95	–	–	PUNCT
ecletica-1352	159	96	6.4	6.4	NUM
ecletica-1352	159	97	–	–	PUNCT
ecletica-1352	159	98	5.7	5.7	NUM
ecletica-1352	159	99	–	–	PUNCT
ecletica-1352	159	100	11.0	11.0	NUM
ecletica-1352	159	101	–	–	SYM
ecletica-1352	159	102	8.8	8.8	NUM
ecletica-1352	159	103	average	average	ADJ
ecletica-1352	159	104	binding	bind	VERB
ecletica-1352	159	105	affinity	affinity	NOUN
ecletica-1352	159	106	(	(	PUNCT
ecletica-1352	159	107	kcal∙mol–1	kcal∙mol–1	PROPN
ecletica-1352	159	108	)	)	PUNCT
ecletica-1352	159	109	–	–	PUNCT
ecletica-1352	159	110	6.6	6.6	NUM
ecletica-1352	159	111	–	–	PUNCT
ecletica-1352	159	112	6.3	6.3	NUM
ecletica-1352	159	113	–	–	PUNCT
ecletica-1352	159	114	11.2	11.2	NUM
ecletica-1352	159	115	–	–	PUNCT
ecletica-1352	159	116	9.0	9.0	NUM
ecletica-1352	159	117	the	the	DET
ecletica-1352	159	118	standard	standard	PROPN
ecletica-1352	159	119	levofloxacin	levofloxacin	PROPN
ecletica-1352	159	120	inhibitor	inhibitor	NOUN
ecletica-1352	159	121	showed	show	VERB
ecletica-1352	159	122	3	3	NUM
ecletica-1352	159	123	hydrogen	hydrogen	NOUN
ecletica-1352	159	124	bond	bond	NOUN
ecletica-1352	159	125	interactions	interaction	NOUN
ecletica-1352	159	126	with	with	ADP
ecletica-1352	159	127	target	target	NOUN
ecletica-1352	159	128	protein	protein	NOUN
ecletica-1352	159	129	2xcs	2xcs	NOUN
ecletica-1352	159	130	and	and	CCONJ
ecletica-1352	159	131	bond	bond	NOUN
ecletica-1352	159	132	length	length	NOUN
ecletica-1352	159	133	between	between	ADP
ecletica-1352	159	134	2.62–2.69	2.62–2.69	NOUN
ecletica-1352	159	135	å	å	NOUN
ecletica-1352	159	136	.	.	PUNCT
ecletica-1352	160	1	while	while	SCONJ
ecletica-1352	160	2	,	,	PUNCT
ecletica-1352	160	3	[	[	X
ecletica-1352	160	4	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	160	5	showed	show	VERB
ecletica-1352	160	6	11	11	NUM
ecletica-1352	160	7	hydrogen	hydrogen	NOUN
ecletica-1352	160	8	bond	bond	NOUN
ecletica-1352	160	9	interactions	interaction	NOUN
ecletica-1352	160	10	:	:	PUNCT
ecletica-1352	160	11	5	5	NUM
ecletica-1352	160	12	donors	donor	NOUN
ecletica-1352	160	13	from	from	ADP
ecletica-1352	160	14	target	target	NOUN
ecletica-1352	160	15	,	,	PUNCT
ecletica-1352	160	16	5	5	NUM
ecletica-1352	160	17	donors	donor	NOUN
ecletica-1352	160	18	from	from	ADP
ecletica-1352	160	19	ligand	ligand	ADJ
ecletica-1352	160	20	and	and	CCONJ
ecletica-1352	160	21	1	1	NUM
ecletica-1352	160	22	donor	donor	NOUN
ecletica-1352	160	23	from	from	ADP
ecletica-1352	160	24	either	either	CCONJ
ecletica-1352	160	25	target	target	NOUN
ecletica-1352	160	26	or	or	CCONJ
ecletica-1352	160	27	ligand	ligand	NOUN
ecletica-1352	160	28	(	(	PUNCT
ecletica-1352	160	29	fig	fig	NOUN
ecletica-1352	160	30	.	.	PUNCT
ecletica-1352	161	1	3	3	NUM
ecletica-1352	161	2	)	)	PUNCT
ecletica-1352	161	3	.	.	PUNCT
ecletica-1352	162	1	the	the	DET
ecletica-1352	162	2	bond	bond	NOUN
ecletica-1352	162	3	lengths	length	NOUN
ecletica-1352	162	4	ranges	range	VERB
ecletica-1352	162	5	from	from	ADP
ecletica-1352	162	6	2.6–3.5	2.6–3.5	NUM
ecletica-1352	162	7	å	å	NOUN
ecletica-1352	162	8	.	.	PUNCT
ecletica-1352	163	1	analysis	analysis	NOUN
ecletica-1352	163	2	of	of	ADP
ecletica-1352	163	3	highresolution	highresolution	NOUN
ecletica-1352	163	4	crystallographic	crystallographic	ADJ
ecletica-1352	163	5	structures	structure	NOUN
ecletica-1352	163	6	for	for	ADP
ecletica-1352	163	7	protein	protein	NOUN
ecletica-1352	163	8	-	-	PUNCT
ecletica-1352	163	9	ligand	ligand	NOUN
ecletica-1352	163	10	complexed	complexed	NOUN
ecletica-1352	163	11	revealed	reveal	VERB
ecletica-1352	163	12	that	that	SCONJ
ecletica-1352	163	13	the	the	DET
ecletica-1352	163	14	typical	typical	ADJ
ecletica-1352	163	15	hydrogen	hydrogen	NOUN
ecletica-1352	163	16	bond	bond	NOUN
ecletica-1352	163	17	distance	distance	NOUN
ecletica-1352	163	18	between	between	ADP
ecletica-1352	163	19	the	the	DET
ecletica-1352	163	20	donor	donor	NOUN
ecletica-1352	163	21	and	and	CCONJ
ecletica-1352	163	22	acceptor	acceptor	NOUN
ecletica-1352	163	23	atom	atom	NOUN
ecletica-1352	163	24	ranges	range	VERB
ecletica-1352	163	25	from	from	ADP
ecletica-1352	163	26	2.5–3.4	2.5–3.4	NOUN
ecletica-1352	163	27	å	å	X
ecletica-1352	163	28	the	the	DET
ecletica-1352	163	29	graphical	graphical	ADJ
ecletica-1352	163	30	representation	representation	NOUN
ecletica-1352	163	31	of	of	ADP
ecletica-1352	163	32	intermolecular	intermolecular	ADJ
ecletica-1352	163	33	hydrogen	hydrogen	NOUN
ecletica-1352	163	34	bonds	bond	NOUN
ecletica-1352	163	35	for	for	ADP
ecletica-1352	163	36	protein	protein	NOUN
ecletica-1352	163	37	-	-	PUNCT
ecletica-1352	163	38	ligand	ligand	NOUN
ecletica-1352	163	39	complexes	complex	NOUN
ecletica-1352	163	40	is	be	AUX
ecletica-1352	163	41	of	of	ADP
ecletica-1352	163	42	pivotal	pivotal	ADJ
ecletica-1352	163	43	importance	importance	NOUN
ecletica-1352	163	44	for	for	ADP
ecletica-1352	163	45	the	the	DET
ecletica-1352	163	46	evaluation	evaluation	NOUN
ecletica-1352	163	47	of	of	ADP
ecletica-1352	163	48	the	the	DET
ecletica-1352	163	49	residues	residue	NOUN
ecletica-1352	163	50	responsible	responsible	ADJ
ecletica-1352	163	51	for	for	ADP
ecletica-1352	163	52	ligand	ligand	ADJ
ecletica-1352	163	53	binding	bind	VERB
ecletica-1352	163	54	affinity	affinity	NOUN
ecletica-1352	163	55	,	,	PUNCT
ecletica-1352	163	56	as	as	SCONJ
ecletica-1352	163	57	presented	present	VERB
ecletica-1352	163	58	in	in	ADP
ecletica-1352	163	59	fig	fig	NOUN
ecletica-1352	163	60	.	.	PUNCT
ecletica-1352	164	1	s1	s1	NOUN
ecletica-1352	164	2	and	and	CCONJ
ecletica-1352	164	3	s2	s2	PROPN
ecletica-1352	164	4	of	of	ADP
ecletica-1352	164	5	the	the	DET
ecletica-1352	164	6	supplementary	supplementary	ADJ
ecletica-1352	164	7	information	information	NOUN
ecletica-1352	164	8	.	.	PUNCT
ecletica-1352	165	1	table	table	NOUN
ecletica-1352	165	2	7	7	NUM
ecletica-1352	165	3	shows	show	VERB
ecletica-1352	165	4	the	the	DET
ecletica-1352	165	5	energy	energy	NOUN
ecletica-1352	165	6	overall	overall	ADJ
ecletica-1352	165	7	descriptors	descriptor	NOUN
ecletica-1352	165	8	for	for	ADP
ecletica-1352	165	9	the	the	DET
ecletica-1352	165	10	interaction	interaction	NOUN
ecletica-1352	165	11	of	of	ADP
ecletica-1352	165	12	1d7u	1d7u	NUM
ecletica-1352	165	13	and	and	CCONJ
ecletica-1352	165	14	2xcs	2xcs	NUM
ecletica-1352	165	15	with	with	ADP
ecletica-1352	165	16	standard	standard	ADJ
ecletica-1352	165	17	levofloxacin	levofloxacin	PROPN
ecletica-1352	165	18	and	and	CCONJ
ecletica-1352	165	19	[	[	X
ecletica-1352	165	20	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	165	21	.	.	PUNCT
ecletica-1352	166	1	the	the	DET
ecletica-1352	166	2	average	average	ADJ
ecletica-1352	166	3	binding	bind	VERB
ecletica-1352	166	4	score	score	NOUN
ecletica-1352	166	5	obtained	obtain	VERB
ecletica-1352	166	6	and	and	CCONJ
ecletica-1352	166	7	the	the	DET
ecletica-1352	166	8	number	number	NOUN
ecletica-1352	166	9	of	of	ADP
ecletica-1352	166	10	hydrogen	hydrogen	NOUN
ecletica-1352	166	11	bond	bond	NOUN
ecletica-1352	166	12	interactions	interaction	NOUN
ecletica-1352	166	13	found	find	VERB
ecletica-1352	166	14	when	when	SCONJ
ecletica-1352	166	15	[	[	X
ecletica-1352	166	16	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	166	17	was	be	AUX
ecletica-1352	166	18	docked	dock	VERB
ecletica-1352	166	19	against	against	ADP
ecletica-1352	166	20	the	the	DET
ecletica-1352	166	21	receptor	receptor	NOUN
ecletica-1352	166	22	proteins	protein	NOUN
ecletica-1352	166	23	1d7u	1d7u	NUM
ecletica-1352	166	24	and	and	CCONJ
ecletica-1352	166	25	2xcs	2xcs	PROPN
ecletica-1352	166	26	showed	show	VERB
ecletica-1352	166	27	that	that	SCONJ
ecletica-1352	166	28	the	the	DET
ecletica-1352	166	29	proposed	propose	VERB
ecletica-1352	166	30	structure	structure	NOUN
ecletica-1352	166	31	fits	fit	VERB
ecletica-1352	166	32	perfectly	perfectly	ADV
ecletica-1352	166	33	at	at	ADP
ecletica-1352	166	34	the	the	DET
ecletica-1352	166	35	active	active	ADJ
ecletica-1352	166	36	site	site	NOUN
ecletica-1352	166	37	of	of	ADP
ecletica-1352	166	38	proteins	protein	NOUN
ecletica-1352	166	39	1d7u	1d7u	NUM
ecletica-1352	166	40	and	and	CCONJ
ecletica-1352	166	41	2xcs	2xcs	NUM
ecletica-1352	166	42	which	which	PRON
ecletica-1352	166	43	results	result	VERB
ecletica-1352	166	44	to	to	ADP
ecletica-1352	166	45	the	the	DET
ecletica-1352	166	46	high	high	ADJ
ecletica-1352	166	47	binding	bind	VERB
ecletica-1352	166	48	affinities	affinity	NOUN
ecletica-1352	166	49	observe	observe	VERB
ecletica-1352	166	50	compared	compare	VERB
ecletica-1352	166	51	to	to	ADP
ecletica-1352	166	52	the	the	DET
ecletica-1352	166	53	commercial	commercial	ADJ
ecletica-1352	166	54	drug	drug	NOUN
ecletica-1352	166	55	levofloxacin	levofloxacin	PROPN
ecletica-1352	166	56	.	.	PUNCT
ecletica-1352	167	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	167	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	167	3	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	PROPN
ecletica-1352	167	4	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p51-54	NOUN
ecletica-1352	167	5	original	original	ADJ
ecletica-1352	167	6	article	article	NOUN
ecletica-1352	167	7	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	167	8	45	45	NUM
ecletica-1352	167	9	eclética	eclética	PROPN
ecletica-1352	167	10	química	química	PROPN
ecletica-1352	167	11	journal	journal	PROPN
ecletica-1352	167	12	,	,	PUNCT
ecletica-1352	167	13	vol	vol	NOUN
ecletica-1352	167	14	.	.	PROPN
ecletica-1352	167	15	47	47	NUM
ecletica-1352	167	16	,	,	PUNCT
ecletica-1352	167	17	n.	n.	NOUN
ecletica-1352	167	18	4	4	NUM
ecletica-1352	167	19	,	,	PUNCT
ecletica-1352	167	20	2022	2022	NUM
ecletica-1352	167	21	,	,	PUNCT
ecletica-1352	167	22	37	37	NUM
ecletica-1352	167	23	-	-	SYM
ecletica-1352	167	24	50	50	NUM
ecletica-1352	167	25	issn	issn	NOUN
ecletica-1352	167	26	:	:	PUNCT
ecletica-1352	167	27	1678	1678	NUM
ecletica-1352	167	28	-	-	SYM
ecletica-1352	167	29	4618	4618	NUM
ecletica-1352	167	30	doi	doi	NOUN
ecletica-1352	167	31	:	:	PUNCT
ecletica-1352	167	32	10.26850/1678	10.26850/1678	NUM
ecletica-1352	167	33	-	-	PUNCT
ecletica-1352	167	34	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	167	35	-	-	PUNCT
ecletica-1352	167	36	50	50	NUM
ecletica-1352	167	37	figure	figure	NOUN
ecletica-1352	167	38	3	3	NUM
ecletica-1352	167	39	.	.	PUNCT
ecletica-1352	168	1	(	(	PUNCT
ecletica-1352	168	2	a	a	X
ecletica-1352	168	3	)	)	PUNCT
ecletica-1352	168	4	pymol	pymol	NOUN
ecletica-1352	168	5	visualization	visualization	NOUN
ecletica-1352	168	6	for	for	ADP
ecletica-1352	168	7	the	the	DET
ecletica-1352	168	8	interaction	interaction	NOUN
ecletica-1352	168	9	between	between	ADP
ecletica-1352	168	10	protein	protein	NOUN
ecletica-1352	168	11	(	(	PUNCT
ecletica-1352	168	12	2xcs	2xcs	PROPN
ecletica-1352	168	13	)	)	PUNCT
ecletica-1352	168	14	with	with	ADP
ecletica-1352	168	15	studied	study	VERB
ecletica-1352	168	16	complex	complex	NOUN
ecletica-1352	168	17	and	and	CCONJ
ecletica-1352	168	18	levofloxacin	levofloxacin	NOUN
ecletica-1352	168	19	(	(	PUNCT
ecletica-1352	168	20	b	b	NOUN
ecletica-1352	168	21	)	)	PUNCT
ecletica-1352	168	22	pymol	pymol	NOUN
ecletica-1352	168	23	visualization	visualization	NOUN
ecletica-1352	168	24	for	for	ADP
ecletica-1352	168	25	the	the	DET
ecletica-1352	168	26	interaction	interaction	NOUN
ecletica-1352	168	27	between	between	ADP
ecletica-1352	168	28	protein	protein	NOUN
ecletica-1352	168	29	(	(	PUNCT
ecletica-1352	168	30	1d7u	1d7u	NUM
ecletica-1352	168	31	)	)	PUNCT
ecletica-1352	168	32	with	with	ADP
ecletica-1352	168	33	the	the	DET
ecletica-1352	168	34	studied	studied	ADJ
ecletica-1352	168	35	complex	complex	NOUN
ecletica-1352	168	36	and	and	CCONJ
ecletica-1352	168	37	levofloxacin	levofloxacin	NOUN
ecletica-1352	168	38	3.5	3.5	NUM
ecletica-1352	168	39	admet	admet	PROPN
ecletica-1352	168	40	studies	study	NOUN
ecletica-1352	168	41	to	to	PART
ecletica-1352	168	42	further	far	ADV
ecletica-1352	168	43	support	support	VERB
ecletica-1352	168	44	the	the	DET
ecletica-1352	168	45	result	result	NOUN
ecletica-1352	168	46	of	of	ADP
ecletica-1352	168	47	docking	dock	VERB
ecletica-1352	168	48	studies	study	NOUN
ecletica-1352	168	49	,	,	PUNCT
ecletica-1352	168	50	we	we	PRON
ecletica-1352	168	51	also	also	ADV
ecletica-1352	168	52	performed	perform	VERB
ecletica-1352	168	53	in	in	ADP
ecletica-1352	168	54	-	-	PUNCT
ecletica-1352	168	55	silico	silico	NOUN
ecletica-1352	168	56	admet	admet	NOUN
ecletica-1352	168	57	studies	study	NOUN
ecletica-1352	168	58	on	on	ADP
ecletica-1352	168	59	the	the	DET
ecletica-1352	168	60	[	[	X
ecletica-1352	168	61	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	168	62	and	and	CCONJ
ecletica-1352	168	63	standard	standard	ADJ
ecletica-1352	168	64	levofloxacin	levofloxacin	NOUN
ecletica-1352	168	65	(	(	PUNCT
ecletica-1352	168	66	reported	report	VERB
ecletica-1352	168	67	in	in	ADP
ecletica-1352	168	68	tab	tab	NOUN
ecletica-1352	168	69	.	.	PUNCT
ecletica-1352	168	70	8)	8)	NUM
ecletica-1352	168	71	as	as	ADP
ecletica-1352	168	72	the	the	DET
ecletica-1352	168	73	interactions	interaction	NOUN
ecletica-1352	168	74	of	of	ADP
ecletica-1352	168	75	inhibitor	inhibitor	NOUN
ecletica-1352	168	76	with	with	ADP
ecletica-1352	168	77	a	a	DET
ecletica-1352	168	78	protein	protein	NOUN
ecletica-1352	168	79	can	can	AUX
ecletica-1352	168	80	not	not	PART
ecletica-1352	168	81	promise	promise	VERB
ecletica-1352	168	82	its	its	PRON
ecletica-1352	168	83	suitability	suitability	NOUN
ecletica-1352	168	84	as	as	ADP
ecletica-1352	168	85	a	a	DET
ecletica-1352	168	86	drug	drug	NOUN
ecletica-1352	168	87	.	.	PUNCT
ecletica-1352	169	1	swissadme	swissadme	NOUN
ecletica-1352	169	2	and	and	CCONJ
ecletica-1352	169	3	pkcsm	pkcsm	NOUN
ecletica-1352	169	4	are	be	AUX
ecletica-1352	169	5	online	online	ADJ
ecletica-1352	169	6	platforms	platform	NOUN
ecletica-1352	169	7	used	use	VERB
ecletica-1352	169	8	to	to	PART
ecletica-1352	169	9	predict	predict	VERB
ecletica-1352	169	10	to	to	ADP
ecletica-1352	169	11	a	a	DET
ecletica-1352	169	12	certain	certain	ADJ
ecletica-1352	169	13	point	point	NOUN
ecletica-1352	169	14	the	the	DET
ecletica-1352	169	15	false	false	ADJ
ecletica-1352	169	16	-	-	PUNCT
ecletica-1352	169	17	positive	positive	ADJ
ecletica-1352	169	18	results	result	NOUN
ecletica-1352	169	19	commonly	commonly	ADV
ecletica-1352	169	20	observed	observe	VERB
ecletica-1352	169	21	in	in	ADP
ecletica-1352	169	22	the	the	DET
ecletica-1352	169	23	bioactive	bioactive	ADJ
ecletica-1352	169	24	form	form	NOUN
ecletica-1352	169	25	of	of	ADP
ecletica-1352	169	26	small	small	ADJ
ecletica-1352	169	27	compounds	compound	NOUN
ecletica-1352	169	28	(	(	PUNCT
ecletica-1352	169	29	emori	emori	NOUN
ecletica-1352	169	30	et	et	PROPN
ecletica-1352	169	31	al	al	PROPN
ecletica-1352	169	32	.	.	PROPN
ecletica-1352	169	33	,	,	PUNCT
ecletica-1352	169	34	2022	2022	NUM
ecletica-1352	169	35	)	)	PUNCT
ecletica-1352	169	36	.	.	PUNCT
ecletica-1352	170	1	the	the	DET
ecletica-1352	170	2	bioavailability	bioavailability	NOUN
ecletica-1352	170	3	radar	radar	NOUN
ecletica-1352	170	4	plots	plot	NOUN
ecletica-1352	170	5	(	(	PUNCT
ecletica-1352	170	6	fig	fig	NOUN
ecletica-1352	170	7	.	.	PUNCT
ecletica-1352	170	8	4	4	X
ecletica-1352	170	9	)	)	PUNCT
ecletica-1352	170	10	gives	give	VERB
ecletica-1352	170	11	a	a	DET
ecletica-1352	170	12	graphical	graphical	ADJ
ecletica-1352	170	13	picture	picture	NOUN
ecletica-1352	170	14	of	of	ADP
ecletica-1352	170	15	the	the	DET
ecletica-1352	170	16	drug	drug	NOUN
ecletica-1352	170	17	-	-	PUNCT
ecletica-1352	170	18	likeness	likeness	NOUN
ecletica-1352	170	19	parameters	parameter	NOUN
ecletica-1352	170	20	of	of	ADP
ecletica-1352	170	21	the	the	DET
ecletica-1352	170	22	investigated	investigate	VERB
ecletica-1352	170	23	compounds	compound	NOUN
ecletica-1352	170	24	which	which	PRON
ecletica-1352	170	25	describes	describe	VERB
ecletica-1352	170	26	the	the	DET
ecletica-1352	170	27	oral	oral	ADJ
ecletica-1352	170	28	availability	availability	NOUN
ecletica-1352	170	29	of	of	ADP
ecletica-1352	170	30	the	the	DET
ecletica-1352	170	31	bioactive	bioactive	ADJ
ecletica-1352	170	32	molecules	molecule	NOUN
ecletica-1352	170	33	.	.	PUNCT
ecletica-1352	171	1	here	here	ADV
ecletica-1352	171	2	,	,	PUNCT
ecletica-1352	171	3	[	[	X
ecletica-1352	171	4	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	171	5	presents	present	VERB
ecletica-1352	171	6	only	only	ADV
ecletica-1352	171	7	one	one	NUM
ecletica-1352	171	8	off	off	ADJ
ecletica-1352	171	9	-	-	PUNCT
ecletica-1352	171	10	shoot	shoot	NOUN
ecletica-1352	171	11	relative	relative	ADJ
ecletica-1352	171	12	to	to	ADP
ecletica-1352	171	13	unsaturation	unsaturation	NOUN
ecletica-1352	171	14	(	(	PUNCT
ecletica-1352	171	15	insatu	insatu	ADJ
ecletica-1352	171	16	)	)	PUNCT
ecletica-1352	171	17	vertex	vertex	NOUN
ecletica-1352	171	18	,	,	PUNCT
ecletica-1352	171	19	leading	lead	VERB
ecletica-1352	171	20	to	to	ADP
ecletica-1352	171	21	suboptimal	suboptimal	ADJ
ecletica-1352	171	22	physiochemical	physiochemical	ADJ
ecletica-1352	171	23	properties	property	NOUN
ecletica-1352	171	24	for	for	ADP
ecletica-1352	171	25	their	their	PRON
ecletica-1352	171	26	oral	oral	ADJ
ecletica-1352	171	27	bioavailability	bioavailability	NOUN
ecletica-1352	171	28	(	(	PUNCT
ecletica-1352	171	29	huxford	huxford	NOUN
ecletica-1352	171	30	et	et	PROPN
ecletica-1352	171	31	al	al	PROPN
ecletica-1352	171	32	.	.	PROPN
ecletica-1352	171	33	,	,	PUNCT
ecletica-1352	171	34	2010	2010	NUM
ecletica-1352	171	35	)	)	PUNCT
ecletica-1352	171	36	while	while	SCONJ
ecletica-1352	171	37	standard	standard	ADJ
ecletica-1352	171	38	levofloxacin	levofloxacin	PROPN
ecletica-1352	171	39	has	have	AUX
ecletica-1352	171	40	been	be	AUX
ecletica-1352	171	41	predicted	predict	VERB
ecletica-1352	171	42	as	as	ADP
ecletica-1352	171	43	orally	orally	ADV
ecletica-1352	171	44	bioavailable	bioavailable	ADJ
ecletica-1352	171	45	.	.	PUNCT
ecletica-1352	172	1	in	in	ADP
ecletica-1352	172	2	addition	addition	NOUN
ecletica-1352	172	3	to	to	ADP
ecletica-1352	172	4	the	the	DET
ecletica-1352	172	5	lipinski	lipinski	PROPN
ecletica-1352	172	6	rule	rule	NOUN
ecletica-1352	172	7	of	of	ADP
ecletica-1352	172	8	five	five	NUM
ecletica-1352	172	9	(	(	PUNCT
ecletica-1352	172	10	jia	jia	PROPN
ecletica-1352	172	11	et	et	PROPN
ecletica-1352	172	12	al	al	PROPN
ecletica-1352	172	13	.	.	PROPN
ecletica-1352	172	14	,	,	PUNCT
ecletica-1352	172	15	2020	2020	NUM
ecletica-1352	172	16	)	)	PUNCT
ecletica-1352	172	17	,	,	PUNCT
ecletica-1352	172	18	another	another	DET
ecletica-1352	172	19	four	four	NUM
ecletica-1352	172	20	drug	drug	NOUN
ecletica-1352	172	21	-	-	PUNCT
ecletica-1352	172	22	likeness	likeness	NOUN
ecletica-1352	172	23	rules	rule	NOUN
ecletica-1352	172	24	named	name	VERB
ecletica-1352	172	25	ghose	ghose	PROPN
ecletica-1352	172	26	,	,	PUNCT
ecletica-1352	172	27	egan	egan	PROPN
ecletica-1352	172	28	,	,	PUNCT
ecletica-1352	172	29	veber	veber	PROPN
ecletica-1352	172	30	and	and	CCONJ
ecletica-1352	172	31	muegee	muegee	PROPN
ecletica-1352	172	32	(	(	PUNCT
ecletica-1352	172	33	daina	daina	PROPN
ecletica-1352	172	34	et	et	PROPN
ecletica-1352	172	35	al	al	PROPN
ecletica-1352	172	36	.	.	PROPN
ecletica-1352	172	37	,	,	PUNCT
ecletica-1352	172	38	2017	2017	NUM
ecletica-1352	172	39	)	)	PUNCT
ecletica-1352	172	40	were	be	AUX
ecletica-1352	172	41	satisfied	satisfied	ADJ
ecletica-1352	172	42	by	by	ADP
ecletica-1352	172	43	levofloxacin	levofloxacin	PROPN
ecletica-1352	172	44	.	.	PUNCT
ecletica-1352	173	1	while	while	SCONJ
ecletica-1352	173	2	[	[	X
ecletica-1352	173	3	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	173	4	passed	pass	VERB
ecletica-1352	173	5	four	four	NUM
ecletica-1352	173	6	of	of	ADP
ecletica-1352	173	7	five	five	NUM
ecletica-1352	173	8	drug	drug	NOUN
ecletica-1352	173	9	-	-	PUNCT
ecletica-1352	173	10	likeness	likeness	NOUN
ecletica-1352	173	11	rules	rule	NOUN
ecletica-1352	173	12	,	,	PUNCT
ecletica-1352	173	13	it	it	PRON
ecletica-1352	173	14	violated	violate	VERB
ecletica-1352	173	15	egan	egan	PROPN
ecletica-1352	173	16	rule	rule	NOUN
ecletica-1352	173	17	(	(	PUNCT
ecletica-1352	173	18	tpsa	tpsa	NOUN
ecletica-1352	173	19	<	<	X
ecletica-1352	173	20	131.6	131.6	NUM
ecletica-1352	173	21	å2	å2	NOUN
ecletica-1352	173	22	)	)	PUNCT
ecletica-1352	173	23	by	by	ADP
ecletica-1352	173	24	having	have	VERB
ecletica-1352	173	25	a	a	DET
ecletica-1352	173	26	topological	topological	ADJ
ecletica-1352	173	27	surface	surface	NOUN
ecletica-1352	173	28	area	area	NOUN
ecletica-1352	173	29	(	(	PUNCT
ecletica-1352	173	30	tpsa)value	tpsa)value	NOUN
ecletica-1352	173	31	of	of	ADP
ecletica-1352	173	32	133.52	133.52	NUM
ecletica-1352	173	33	å2	å2	NOUN
ecletica-1352	173	34	.	.	PUNCT
ecletica-1352	174	1	the	the	DET
ecletica-1352	174	2	brain	brain	NOUN
ecletica-1352	174	3	or	or	CCONJ
ecletica-1352	174	4	intestinal	intestinal	ADJ
ecletica-1352	174	5	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	NOUN
ecletica-1352	174	6	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	174	7	original	original	ADJ
ecletica-1352	174	8	article	article	NOUN
ecletica-1352	174	9	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	174	10	46	46	NUM
ecletica-1352	174	11	eclética	eclética	PROPN
ecletica-1352	174	12	química	química	PROPN
ecletica-1352	174	13	journal	journal	PROPN
ecletica-1352	174	14	,	,	PUNCT
ecletica-1352	174	15	vol	vol	NOUN
ecletica-1352	174	16	.	.	PROPN
ecletica-1352	174	17	47	47	NUM
ecletica-1352	174	18	,	,	PUNCT
ecletica-1352	174	19	n.	n.	NOUN
ecletica-1352	174	20	4	4	NUM
ecletica-1352	174	21	,	,	PUNCT
ecletica-1352	174	22	2022	2022	NUM
ecletica-1352	174	23	,	,	PUNCT
ecletica-1352	174	24	37	37	NUM
ecletica-1352	174	25	-	-	SYM
ecletica-1352	174	26	50	50	NUM
ecletica-1352	174	27	issn	issn	NOUN
ecletica-1352	174	28	:	:	PUNCT
ecletica-1352	174	29	1678	1678	NUM
ecletica-1352	174	30	-	-	SYM
ecletica-1352	174	31	4618	4618	NUM
ecletica-1352	174	32	doi	doi	NOUN
ecletica-1352	174	33	:	:	PUNCT
ecletica-1352	174	34	10.26850/1678	10.26850/1678	NUM
ecletica-1352	174	35	-	-	PUNCT
ecletica-1352	174	36	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	174	37	-	-	PUNCT
ecletica-1352	174	38	50	50	NUM
ecletica-1352	174	39	estimated	estimate	VERB
ecletica-1352	174	40	(	(	PUNCT
ecletica-1352	174	41	boiled	boil	VERB
ecletica-1352	174	42	)	)	PUNCT
ecletica-1352	174	43	permeation	permeation	NOUN
ecletica-1352	174	44	predictive	predictive	ADJ
ecletica-1352	174	45	model	model	NOUN
ecletica-1352	174	46	(	(	PUNCT
ecletica-1352	174	47	boiled	boil	VERB
ecletica-1352	174	48	-	-	PUNCT
ecletica-1352	174	49	egg	egg	NOUN
ecletica-1352	174	50	)	)	PUNCT
ecletica-1352	174	51	is	be	AUX
ecletica-1352	174	52	an	an	DET
ecletica-1352	174	53	extended	extended	ADJ
ecletica-1352	174	54	and	and	CCONJ
ecletica-1352	174	55	renewed	renew	VERB
ecletica-1352	174	56	version	version	NOUN
ecletica-1352	174	57	of	of	ADP
ecletica-1352	174	58	the	the	DET
ecletica-1352	174	59	edan	edan	PROPN
ecletica-1352	174	60	-	-	PUNCT
ecletica-1352	174	61	egg	egg	NOUN
ecletica-1352	174	62	model	model	NOUN
ecletica-1352	174	63	used	use	VERB
ecletica-1352	174	64	to	to	PART
ecletica-1352	174	65	visually	visually	ADV
ecletica-1352	174	66	represent	represent	VERB
ecletica-1352	174	67	bloodbrain	bloodbrain	NOUN
ecletica-1352	174	68	barrier	barrier	NOUN
ecletica-1352	174	69	penetration	penetration	NOUN
ecletica-1352	174	70	(	(	PUNCT
ecletica-1352	174	71	bbb	bbb	NOUN
ecletica-1352	174	72	)	)	PUNCT
ecletica-1352	174	73	and	and	CCONJ
ecletica-1352	174	74	human	human	ADJ
ecletica-1352	174	75	gastrointestinal	gastrointestinal	ADJ
ecletica-1352	174	76	absorption	absorption	NOUN
ecletica-1352	174	77	(	(	PUNCT
ecletica-1352	174	78	hia	hia	PROPN
ecletica-1352	174	79	)	)	PUNCT
ecletica-1352	174	80	relative	relative	ADJ
ecletica-1352	174	81	to	to	ADP
ecletica-1352	174	82	the	the	DET
ecletica-1352	174	83	distribution	distribution	NOUN
ecletica-1352	174	84	and	and	CCONJ
ecletica-1352	174	85	absorption	absorption	NOUN
ecletica-1352	174	86	parameters	parameter	NOUN
ecletica-1352	174	87	,	,	PUNCT
ecletica-1352	174	88	respectively	respectively	ADV
ecletica-1352	174	89	.	.	PUNCT
ecletica-1352	175	1	the	the	DET
ecletica-1352	175	2	analysis	analysis	NOUN
ecletica-1352	175	3	of	of	ADP
ecletica-1352	175	4	fig	fig	NOUN
ecletica-1352	175	5	.	.	PUNCT
ecletica-1352	176	1	4	4	NUM
ecletica-1352	176	2	shows	show	VERB
ecletica-1352	176	3	that	that	SCONJ
ecletica-1352	176	4	both	both	PRON
ecletica-1352	176	5	[	[	X
ecletica-1352	176	6	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	176	7	and	and	CCONJ
ecletica-1352	176	8	levofloxacin	levofloxacin	NOUN
ecletica-1352	176	9	were	be	AUX
ecletica-1352	176	10	passively	passively	ADV
ecletica-1352	176	11	absorbed	absorb	VERB
ecletica-1352	176	12	by	by	ADP
ecletica-1352	176	13	the	the	DET
ecletica-1352	176	14	gastrointestinal	gastrointestinal	ADJ
ecletica-1352	176	15	tract	tract	NOUN
ecletica-1352	176	16	but	but	CCONJ
ecletica-1352	176	17	were	be	AUX
ecletica-1352	176	18	not	not	PART
ecletica-1352	176	19	bbb	bbb	NOUN
ecletica-1352	176	20	permeate	permeate	VERB
ecletica-1352	176	21	.	.	PUNCT
ecletica-1352	177	1	figure	figure	NOUN
ecletica-1352	177	2	4	4	NUM
ecletica-1352	177	3	.	.	PUNCT
ecletica-1352	178	1	radar	radar	NOUN
ecletica-1352	178	2	plot	plot	NOUN
ecletica-1352	178	3	of	of	ADP
ecletica-1352	178	4	the	the	DET
ecletica-1352	178	5	six	six	NUM
ecletica-1352	178	6	drug	drug	NOUN
ecletica-1352	178	7	-	-	PUNCT
ecletica-1352	178	8	likeness	likeness	NOUN
ecletica-1352	178	9	parameters	parameter	NOUN
ecletica-1352	178	10	used	use	VERB
ecletica-1352	178	11	to	to	PART
ecletica-1352	178	12	predict	predict	VERB
ecletica-1352	178	13	the	the	DET
ecletica-1352	178	14	oral	oral	ADJ
ecletica-1352	178	15	bioavailability	bioavailability	NOUN
ecletica-1352	178	16	of	of	ADP
ecletica-1352	178	17	[	[	X
ecletica-1352	178	18	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	178	19	and	and	CCONJ
ecletica-1352	178	20	standard	standard	ADJ
ecletica-1352	178	21	levofloxacin	levofloxacin	PROPN
ecletica-1352	178	22	.	.	PUNCT
ecletica-1352	179	1	table	table	NOUN
ecletica-1352	179	2	8	8	NUM
ecletica-1352	179	3	.	.	PUNCT
ecletica-1352	180	1	pkcsm	pkcsm	NOUN
ecletica-1352	180	2	results	result	NOUN
ecletica-1352	180	3	of	of	ADP
ecletica-1352	180	4	[	[	X
ecletica-1352	180	5	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	180	6	and	and	CCONJ
ecletica-1352	180	7	levofloxacin	levofloxacin	NOUN
ecletica-1352	180	8	.	.	PUNCT
ecletica-1352	181	1	molecule	molecule	NOUN
ecletica-1352	181	2	i	i	PROPN
ecletica-1352	181	3	d	d	PROPN
ecletica-1352	182	1	[	[	X
ecletica-1352	182	2	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	182	3	levofloxacin	levofloxacin	NOUN
ecletica-1352	182	4	absorption	absorption	NOUN
ecletica-1352	182	5	caco-2	caco-2	NUM
ecletica-1352	182	6	permeability	permeability	NOUN
ecletica-1352	182	7	0.146	0.146	NUM
ecletica-1352	182	8	1.449	1.449	NUM
ecletica-1352	182	9	human	human	ADJ
ecletica-1352	182	10	intestinal	intestinal	ADJ
ecletica-1352	182	11	absorption	absorption	NOUN
ecletica-1352	182	12	23.874	23.874	NUM
ecletica-1352	182	13	96.053	96.053	NUM
ecletica-1352	182	14	skin	skin	NOUN
ecletica-1352	182	15	permeability	permeability	NOUN
ecletica-1352	182	16	–	–	PUNCT
ecletica-1352	182	17	2.735	2.735	NUM
ecletica-1352	182	18	–	–	SYM
ecletica-1352	182	19	2.735	2.735	NUM
ecletica-1352	182	20	distribution	distribution	NOUN
ecletica-1352	182	21	vdss	vdss	ADV
ecletica-1352	182	22	(	(	PUNCT
ecletica-1352	182	23	human	human	NOUN
ecletica-1352	182	24	)	)	PUNCT
ecletica-1352	182	25	–	–	PUNCT
ecletica-1352	182	26	1.469	1.469	NUM
ecletica-1352	182	27	0.193	0.193	NUM
ecletica-1352	182	28	fraction	fraction	NOUN
ecletica-1352	182	29	unbound	unbound	NOUN
ecletica-1352	182	30	(	(	PUNCT
ecletica-1352	182	31	human	human	NOUN
ecletica-1352	182	32	)	)	PUNCT
ecletica-1352	182	33	0.517	0.517	NUM
ecletica-1352	182	34	0.609	0.609	NUM
ecletica-1352	182	35	cns	cns	NOUN
ecletica-1352	182	36	permeability	permeability	NOUN
ecletica-1352	182	37	–	–	PUNCT
ecletica-1352	182	38	3.574	3.574	NUM
ecletica-1352	182	39	–	–	SYM
ecletica-1352	182	40	3.05	3.05	NUM
ecletica-1352	182	41	excretion	excretion	NOUN
ecletica-1352	182	42	total	total	NOUN
ecletica-1352	182	43	clearance	clearance	NOUN
ecletica-1352	182	44	1.187	1.187	NUM
ecletica-1352	182	45	0.317	0.317	NUM
ecletica-1352	182	46	renal	renal	ADJ
ecletica-1352	182	47	oct2	oct2	NOUN
ecletica-1352	182	48	substrate	substrate	NOUN
ecletica-1352	182	49	no	no	DET
ecletica-1352	182	50	no	no	DET
ecletica-1352	182	51	toxicity	toxicity	NOUN
ecletica-1352	182	52	ames	ame	NOUN
ecletica-1352	182	53	toxicity	toxicity	NOUN
ecletica-1352	182	54	no	no	PRON
ecletica-1352	182	55	no	no	DET
ecletica-1352	182	56	oral	oral	ADJ
ecletica-1352	182	57	rat	rat	NOUN
ecletica-1352	182	58	acute	acute	NOUN
ecletica-1352	182	59	toxicity	toxicity	NOUN
ecletica-1352	182	60	(	(	PUNCT
ecletica-1352	182	61	ld50	ld50	PROPN
ecletica-1352	182	62	)	)	PUNCT
ecletica-1352	182	63	2.128	2.128	NUM
ecletica-1352	182	64	2.276	2.276	NUM
ecletica-1352	182	65	minnow	minnow	NOUN
ecletica-1352	182	66	toxicity	toxicity	NOUN
ecletica-1352	182	67	(	(	PUNCT
ecletica-1352	182	68	lc50	lc50	PROPN
ecletica-1352	182	69	)	)	PUNCT
ecletica-1352	182	70	3.972	3.972	NUM
ecletica-1352	182	71	1.788	1.788	NUM
ecletica-1352	182	72	semaphore	semaphore	NOUN
ecletica-1352	182	73	flags	flag	NOUN
ecletica-1352	182	74	:	:	PUNCT
ecletica-1352	182	75	green	green	ADJ
ecletica-1352	182	76	=	=	SYM
ecletica-1352	182	77	good	good	ADJ
ecletica-1352	182	78	,	,	PUNCT
ecletica-1352	182	79	yellow	yellow	ADJ
ecletica-1352	182	80	=	=	SYM
ecletica-1352	182	81	tolerable	tolerable	ADJ
ecletica-1352	182	82	,	,	PUNCT
ecletica-1352	182	83	and	and	CCONJ
ecletica-1352	182	84	red	red	ADJ
ecletica-1352	182	85	=	=	SYM
ecletica-1352	182	86	bad	bad	ADJ
ecletica-1352	182	87	.	.	PUNCT
ecletica-1352	183	1	the	the	DET
ecletica-1352	183	2	absorption	absorption	NOUN
ecletica-1352	183	3	parameters	parameter	NOUN
ecletica-1352	183	4	using	use	VERB
ecletica-1352	183	5	pkcsm	pkcsm	NOUN
ecletica-1352	183	6	online	online	ADJ
ecletica-1352	183	7	tool	tool	NOUN
ecletica-1352	183	8	shows	show	VERB
ecletica-1352	183	9	that	that	SCONJ
ecletica-1352	183	10	levofloxacin	levofloxacin	PROPN
ecletica-1352	183	11	is	be	AUX
ecletica-1352	183	12	a	a	DET
ecletica-1352	183	13	more	more	ADV
ecletica-1352	183	14	promising	promising	ADJ
ecletica-1352	183	15	oral	oral	ADJ
ecletica-1352	183	16	availability	availability	NOUN
ecletica-1352	183	17	due	due	ADP
ecletica-1352	183	18	to	to	ADP
ecletica-1352	183	19	the	the	DET
ecletica-1352	183	20	optimal	optimal	ADJ
ecletica-1352	183	21	caco-2	caco-2	NUM
ecletica-1352	183	22	-	-	PUNCT
ecletica-1352	183	23	cell	cell	NOUN
ecletica-1352	183	24	permeability	permeability	NOUN
ecletica-1352	183	25	(	(	PUNCT
ecletica-1352	183	26	>	>	X
ecletica-1352	183	27	0.9	0.9	NUM
ecletica-1352	183	28	)	)	PUNCT
ecletica-1352	183	29	and	and	CCONJ
ecletica-1352	183	30	hia	hia	PROPN
ecletica-1352	183	31	(	(	PUNCT
ecletica-1352	183	32	>	>	X
ecletica-1352	183	33	90	90	NUM
ecletica-1352	183	34	%	%	NOUN
ecletica-1352	183	35	)	)	PUNCT
ecletica-1352	183	36	.	.	PUNCT
ecletica-1352	184	1	finally	finally	ADV
ecletica-1352	184	2	,	,	PUNCT
ecletica-1352	184	3	[	[	X
ecletica-1352	184	4	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	184	5	and	and	CCONJ
ecletica-1352	184	6	levofloxacin	levofloxacin	NOUN
ecletica-1352	184	7	are	be	AUX
ecletica-1352	184	8	good	good	ADJ
ecletica-1352	184	9	skin	skin	NOUN
ecletica-1352	184	10	permeable	permeable	ADJ
ecletica-1352	184	11	compounds	compound	NOUN
ecletica-1352	184	12	(	(	PUNCT
ecletica-1352	184	13	logkp	logkp	X
ecletica-1352	184	14	<	<	X
ecletica-1352	184	15	–	–	PUNCT
ecletica-1352	184	16	2.5	2.5	NUM
ecletica-1352	184	17	)	)	PUNCT
ecletica-1352	184	18	.	.	PUNCT
ecletica-1352	185	1	regarding	regard	VERB
ecletica-1352	185	2	the	the	DET
ecletica-1352	185	3	distributions	distribution	NOUN
ecletica-1352	185	4	parameters	parameter	NOUN
ecletica-1352	185	5	,	,	PUNCT
ecletica-1352	185	6	the	the	DET
ecletica-1352	185	7	two	two	NUM
ecletica-1352	185	8	most	most	ADV
ecletica-1352	185	9	important	important	ADJ
ecletica-1352	185	10	pharmacokinetic	pharmacokinetic	ADJ
ecletica-1352	185	11	drug	drug	NOUN
ecletica-1352	185	12	parameters	parameter	NOUN
ecletica-1352	185	13	are	be	AUX
ecletica-1352	185	14	volume	volume	NOUN
ecletica-1352	185	15	of	of	ADP
ecletica-1352	185	16	distribution	distribution	NOUN
ecletica-1352	185	17	of	of	ADP
ecletica-1352	185	18	steady	steady	ADJ
ecletica-1352	185	19	state	state	NOUN
ecletica-1352	185	20	(	(	PUNCT
ecletica-1352	185	21	vdss	vdss	ADJ
ecletica-1352	185	22	)	)	PUNCT
ecletica-1352	185	23	and	and	CCONJ
ecletica-1352	185	24	unbound	unbound	NOUN
ecletica-1352	185	25	fraction	fraction	NOUN
ecletica-1352	185	26	.	.	PUNCT
ecletica-1352	186	1	vdss	vdss	ADV
ecletica-1352	186	2	describes	describe	VERB
ecletica-1352	186	3	the	the	DET
ecletica-1352	186	4	extent	extent	NOUN
ecletica-1352	186	5	of	of	ADP
ecletica-1352	186	6	distribution	distribution	NOUN
ecletica-1352	186	7	of	of	ADP
ecletica-1352	186	8	the	the	DET
ecletica-1352	186	9	drug	drug	NOUN
ecletica-1352	186	10	and	and	CCONJ
ecletica-1352	186	11	the	the	DET
ecletica-1352	186	12	unbound	unbound	NOUN
ecletica-1352	186	13	fraction	fraction	NOUN
ecletica-1352	186	14	describes	describe	VERB
ecletica-1352	186	15	the	the	DET
ecletica-1352	186	16	portion	portion	NOUN
ecletica-1352	186	17	of	of	ADP
ecletica-1352	186	18	the	the	DET
ecletica-1352	186	19	free	free	ADJ
ecletica-1352	186	20	drug	drug	NOUN
ecletica-1352	186	21	in	in	ADP
ecletica-1352	186	22	plasma	plasma	NOUN
ecletica-1352	186	23	that	that	PRON
ecletica-1352	186	24	may	may	AUX
ecletica-1352	186	25	leak	leak	VERB
ecletica-1352	186	26	from	from	ADP
ecletica-1352	186	27	the	the	DET
ecletica-1352	186	28	blood	blood	NOUN
ecletica-1352	186	29	vessels	vessel	NOUN
ecletica-1352	186	30	or	or	CCONJ
ecletica-1352	186	31	tube	tube	NOUN
ecletica-1352	186	32	into	into	ADP
ecletica-1352	186	33	the	the	DET
ecletica-1352	186	34	tissues	tissue	NOUN
ecletica-1352	186	35	around	around	ADP
ecletica-1352	186	36	it	it	PRON
ecletica-1352	186	37	(	(	PUNCT
ecletica-1352	186	38	tice	tice	NOUN
ecletica-1352	186	39	,	,	PUNCT
ecletica-1352	186	40	2001	2001	NUM
ecletica-1352	186	41	)	)	PUNCT
ecletica-1352	186	42	.	.	PUNCT
ecletica-1352	187	1	values	value	NOUN
ecletica-1352	187	2	of	of	ADP
ecletica-1352	187	3	vdss	vdss	ADV
ecletica-1352	187	4	>	>	NOUN
ecletica-1352	187	5	0.45	0.45	NUM
ecletica-1352	187	6	indicate	indicate	VERB
ecletica-1352	187	7	that	that	SCONJ
ecletica-1352	187	8	the	the	DET
ecletica-1352	187	9	drug	drug	NOUN
ecletica-1352	187	10	will	will	AUX
ecletica-1352	187	11	be	be	AUX
ecletica-1352	187	12	distributed	distribute	VERB
ecletica-1352	187	13	in	in	ADP
ecletica-1352	187	14	tissue	tissue	NOUN
ecletica-1352	187	15	,	,	PUNCT
ecletica-1352	187	16	whereas	whereas	SCONJ
ecletica-1352	187	17	values	value	NOUN
ecletica-1352	187	18	<	<	X
ecletica-1352	187	19	–	–	PUNCT
ecletica-1352	187	20	0.15	0.15	NUM
ecletica-1352	187	21	indicate	indicate	VERB
ecletica-1352	187	22	that	that	SCONJ
ecletica-1352	187	23	the	the	DET
ecletica-1352	187	24	drug	drug	NOUN
ecletica-1352	187	25	will	will	AUX
ecletica-1352	187	26	be	be	AUX
ecletica-1352	187	27	distributed	distribute	VERB
ecletica-1352	187	28	in	in	ADP
ecletica-1352	187	29	plasma	plasma	NOUN
ecletica-1352	187	30	.	.	PUNCT
ecletica-1352	188	1	so	so	ADV
ecletica-1352	188	2	,	,	PUNCT
ecletica-1352	188	3	[	[	X
ecletica-1352	188	4	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	188	5	has	have	VERB
ecletica-1352	188	6	a	a	DET
ecletica-1352	188	7	vdss	vdss	ADJ
ecletica-1352	188	8	value	value	NOUN
ecletica-1352	188	9	of	of	ADP
ecletica-1352	188	10	–	–	PUNCT
ecletica-1352	188	11	1.469	1.469	NUM
ecletica-1352	188	12	and	and	CCONJ
ecletica-1352	188	13	levofloxacin	levofloxacin	NOUN
ecletica-1352	188	14	0.193	0.193	NUM
ecletica-1352	188	15	and	and	CCONJ
ecletica-1352	188	16	are	be	AUX
ecletica-1352	188	17	within	within	ADP
ecletica-1352	188	18	the	the	DET
ecletica-1352	188	19	unbound	unbound	NOUN
ecletica-1352	188	20	fraction	fraction	NOUN
ecletica-1352	188	21	of	of	ADP
ecletica-1352	188	22	0.5–0.6	0.5–0.6	NOUN
ecletica-1352	188	23	.	.	PUNCT
ecletica-1352	189	1	both	both	DET
ecletica-1352	189	2	compounds	compound	NOUN
ecletica-1352	189	3	do	do	AUX
ecletica-1352	189	4	not	not	PART
ecletica-1352	189	5	penetrate	penetrate	VERB
ecletica-1352	189	6	the	the	DET
ecletica-1352	189	7	central	central	ADJ
ecletica-1352	189	8	nervous	nervous	ADJ
ecletica-1352	189	9	system	system	NOUN
ecletica-1352	189	10	.	.	PUNCT
ecletica-1352	190	1	the	the	DET
ecletica-1352	190	2	predicted	predict	VERB
ecletica-1352	190	3	values	value	NOUN
ecletica-1352	190	4	of	of	ADP
ecletica-1352	190	5	total	total	ADJ
ecletica-1352	190	6	clearance	clearance	NOUN
ecletica-1352	190	7	,	,	PUNCT
ecletica-1352	190	8	that	that	PRON
ecletica-1352	190	9	measures	measure	VERB
ecletica-1352	190	10	the	the	DET
ecletica-1352	190	11	effectiveness	effectiveness	NOUN
ecletica-1352	190	12	of	of	ADP
ecletica-1352	190	13	drug	drug	NOUN
ecletica-1352	190	14	elimination	elimination	NOUN
ecletica-1352	190	15	from	from	ADP
ecletica-1352	190	16	the	the	DET
ecletica-1352	190	17	body	body	NOUN
ecletica-1352	190	18	,	,	PUNCT
ecletica-1352	190	19	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	190	20	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	190	21	original	original	ADJ
ecletica-1352	190	22	article	article	NOUN
ecletica-1352	190	23	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1352	190	24	47	47	NUM
ecletica-1352	190	25	eclética	eclética	PROPN
ecletica-1352	190	26	química	química	PROPN
ecletica-1352	190	27	journal	journal	PROPN
ecletica-1352	190	28	,	,	PUNCT
ecletica-1352	190	29	vol	vol	NOUN
ecletica-1352	190	30	.	.	PROPN
ecletica-1352	191	1	47	47	NUM
ecletica-1352	191	2	,	,	PUNCT
ecletica-1352	191	3	n.	n.	NOUN
ecletica-1352	191	4	4	4	NUM
ecletica-1352	191	5	,	,	PUNCT
ecletica-1352	191	6	2022	2022	NUM
ecletica-1352	191	7	,	,	PUNCT
ecletica-1352	191	8	37	37	NUM
ecletica-1352	191	9	-	-	SYM
ecletica-1352	191	10	50	50	NUM
ecletica-1352	191	11	issn	issn	NOUN
ecletica-1352	191	12	:	:	PUNCT
ecletica-1352	191	13	1678	1678	NUM
ecletica-1352	191	14	-	-	SYM
ecletica-1352	191	15	4618	4618	NUM
ecletica-1352	191	16	doi	doi	NOUN
ecletica-1352	191	17	:	:	PUNCT
ecletica-1352	191	18	10.26850/1678	10.26850/1678	NUM
ecletica-1352	191	19	-	-	PUNCT
ecletica-1352	191	20	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	191	21	-	-	PUNCT
ecletica-1352	191	22	50	50	NUM
ecletica-1352	191	23	indicate	indicate	VERB
ecletica-1352	191	24	that	that	SCONJ
ecletica-1352	191	25	all	all	DET
ecletica-1352	191	26	compounds	compound	NOUN
ecletica-1352	191	27	have	have	VERB
ecletica-1352	191	28	a	a	DET
ecletica-1352	191	29	good	good	ADJ
ecletica-1352	191	30	renal	renal	ADJ
ecletica-1352	191	31	elimination	elimination	NOUN
ecletica-1352	191	32	and	and	CCONJ
ecletica-1352	191	33	are	be	AUX
ecletica-1352	191	34	not	not	PART
ecletica-1352	191	35	substrates	substrate	NOUN
ecletica-1352	191	36	of	of	ADP
ecletica-1352	191	37	the	the	DET
ecletica-1352	191	38	renal	renal	ADJ
ecletica-1352	191	39	organic	organic	ADJ
ecletica-1352	191	40	cation	cation	NOUN
ecletica-1352	191	41	transporter	transporter	NOUN
ecletica-1352	191	42	2	2	NUM
ecletica-1352	191	43	(	(	PUNCT
ecletica-1352	191	44	oct2	oct2	NOUN
ecletica-1352	191	45	)	)	PUNCT
ecletica-1352	191	46	.	.	PUNCT
ecletica-1352	192	1	[	[	X
ecletica-1352	192	2	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	192	3	,	,	PUNCT
ecletica-1352	192	4	unlike	unlike	ADP
ecletica-1352	192	5	the	the	DET
ecletica-1352	192	6	standard	standard	ADJ
ecletica-1352	192	7	levofloxacin	levofloxacin	PROPN
ecletica-1352	192	8	,	,	PUNCT
ecletica-1352	192	9	has	have	VERB
ecletica-1352	192	10	high	high	ADJ
ecletica-1352	192	11	renal	renal	ADJ
ecletica-1352	192	12	clearance	clearance	NOUN
ecletica-1352	192	13	.	.	PUNCT
ecletica-1352	193	1	[	[	X
ecletica-1352	193	2	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	NOUN
ecletica-1352	193	3	did	do	AUX
ecletica-1352	193	4	not	not	PART
ecletica-1352	193	5	pose	pose	VERB
ecletica-1352	193	6	any	any	DET
ecletica-1352	193	7	toxicity	toxicity	NOUN
ecletica-1352	193	8	problems	problem	NOUN
ecletica-1352	193	9	;	;	PUNCT
ecletica-1352	193	10	levofloxacin	levofloxacin	PROPN
ecletica-1352	193	11	,	,	PUNCT
ecletica-1352	193	12	however	however	ADV
ecletica-1352	193	13	,	,	PUNCT
ecletica-1352	193	14	is	be	AUX
ecletica-1352	193	15	hepatotoxic	hepatotoxic	ADJ
ecletica-1352	193	16	and	and	CCONJ
ecletica-1352	193	17	may	may	AUX
ecletica-1352	193	18	be	be	AUX
ecletica-1352	193	19	associated	associate	VERB
ecletica-1352	193	20	with	with	ADP
ecletica-1352	193	21	the	the	DET
ecletica-1352	193	22	interruption	interruption	NOUN
ecletica-1352	193	23	of	of	ADP
ecletica-1352	193	24	normal	normal	ADJ
ecletica-1352	193	25	functions	function	NOUN
ecletica-1352	193	26	of	of	ADP
ecletica-1352	193	27	the	the	DET
ecletica-1352	193	28	liver	liver	NOUN
ecletica-1352	193	29	.	.	PUNCT
ecletica-1352	194	1	4	4	X
ecletica-1352	194	2	.	.	X
ecletica-1352	194	3	conclusions	conclusion	NOUN
ecletica-1352	194	4	experimental	experimental	ADJ
ecletica-1352	194	5	and	and	CCONJ
ecletica-1352	194	6	theoretical	theoretical	ADJ
ecletica-1352	194	7	investigation	investigation	NOUN
ecletica-1352	194	8	of	of	ADP
ecletica-1352	194	9	cadmium	cadmium	NOUN
ecletica-1352	194	10	complex	complex	NOUN
ecletica-1352	194	11	of	of	ADP
ecletica-1352	194	12	benzenetricarboxylates	benzenetricarboxylate	NOUN
ecletica-1352	194	13	in	in	ADP
ecletica-1352	194	14	monoclinic	monoclinic	ADJ
ecletica-1352	194	15	space	space	NOUN
ecletica-1352	194	16	group	group	NOUN
ecletica-1352	194	17	12	12	NUM
ecletica-1352	194	18	/	/	SYM
ecletica-1352	194	19	a	a	PRON
ecletica-1352	194	20	was	be	AUX
ecletica-1352	194	21	observed	observe	VERB
ecletica-1352	194	22	to	to	PART
ecletica-1352	194	23	have	have	VERB
ecletica-1352	194	24	lattice	lattice	NOUN
ecletica-1352	194	25	parameters	parameter	NOUN
ecletica-1352	194	26	a	a	DET
ecletica-1352	194	27	=	=	SYM
ecletica-1352	194	28	13.1508(3	13.1508(3	PROPN
ecletica-1352	194	29	)	)	PUNCT
ecletica-1352	194	30	å	å	PROPN
ecletica-1352	194	31	,	,	PUNCT
ecletica-1352	194	32	b	b	NOUN
ecletica-1352	194	33	=	=	SYM
ecletica-1352	194	34	9.1014(2	9.1014(2	NUM
ecletica-1352	194	35	)	)	PUNCT
ecletica-1352	194	36	å	å	NOUN
ecletica-1352	194	37	,	,	PUNCT
ecletica-1352	194	38	c	c	NOUN
ecletica-1352	194	39	=	=	SYM
ecletica-1352	194	40	17.8971(4	17.8971(4	NUM
ecletica-1352	194	41	)	)	PUNCT
ecletica-1352	194	42	å	å	PROPN
ecletica-1352	194	43	,	,	PUNCT
ecletica-1352	194	44	α	α	NOUN
ecletica-1352	194	45	=	=	SYM
ecletica-1352	194	46	90	90	NUM
ecletica-1352	194	47	°	°	NUM
ecletica-1352	194	48	,	,	PUNCT
ecletica-1352	194	49	β	β	X
ecletica-1352	194	50	=	=	SYM
ecletica-1352	194	51	103.455(2	103.455(2	NUM
ecletica-1352	194	52	)	)	PUNCT
ecletica-1352	194	53	°	°	PROPN
ecletica-1352	194	54	and	and	CCONJ
ecletica-1352	194	55	γ	γ	X
ecletica-1352	194	56	=	=	SYM
ecletica-1352	194	57	90	90	NUM
ecletica-1352	194	58	°	°	NUM
ecletica-1352	194	59	.	.	PUNCT
ecletica-1352	195	1	the	the	DET
ecletica-1352	195	2	structural	structural	ADJ
ecletica-1352	195	3	analysis	analysis	NOUN
ecletica-1352	195	4	revealed	reveal	VERB
ecletica-1352	195	5	hydrogen	hydrogen	NOUN
ecletica-1352	195	6	bonding	bonding	NOUN
ecletica-1352	195	7	(	(	PUNCT
ecletica-1352	195	8	o	o	NOUN
ecletica-1352	195	9	–	–	PUNCT
ecletica-1352	195	10	h	h	NOUN
ecletica-1352	195	11	…	…	PUNCT
ecletica-1352	195	12	…	…	SYM
ecletica-1352	195	13	o	o	NOUN
ecletica-1352	195	14	)	)	PUNCT
ecletica-1352	195	15	interaction	interaction	NOUN
ecletica-1352	195	16	from	from	ADP
ecletica-1352	195	17	the	the	DET
ecletica-1352	195	18	coordinated	coordinate	VERB
ecletica-1352	195	19	water	water	NOUN
ecletica-1352	195	20	molecules	molecule	NOUN
ecletica-1352	195	21	(	(	PUNCT
ecletica-1352	195	22	o1w	o1w	X
ecletica-1352	195	23	and	and	CCONJ
ecletica-1352	195	24	o2w	o2w	NUM
ecletica-1352	195	25	)	)	PUNCT
ecletica-1352	195	26	and	and	CCONJ
ecletica-1352	195	27	the	the	DET
ecletica-1352	195	28	protonated	protonate	VERB
ecletica-1352	195	29	carboxyl	carboxyl	NOUN
ecletica-1352	195	30	group	group	NOUN
ecletica-1352	195	31	of	of	ADP
ecletica-1352	195	32	one	one	NUM
ecletica-1352	195	33	of	of	ADP
ecletica-1352	195	34	the	the	DET
ecletica-1352	195	35	ligands	ligand	NOUN
ecletica-1352	195	36	branched	branch	VERB
ecletica-1352	195	37	into	into	ADP
ecletica-1352	195	38	a	a	DET
ecletica-1352	195	39	threedimensional	threedimensional	ADJ
ecletica-1352	195	40	network	network	NOUN
ecletica-1352	195	41	of	of	ADP
ecletica-1352	195	42	supramolecular	supramolecular	ADJ
ecletica-1352	195	43	structure	structure	NOUN
ecletica-1352	195	44	.	.	PUNCT
ecletica-1352	196	1	from	from	ADP
ecletica-1352	196	2	the	the	DET
ecletica-1352	196	3	reactivity	reactivity	NOUN
ecletica-1352	196	4	parameters	parameter	NOUN
ecletica-1352	196	5	,	,	PUNCT
ecletica-1352	196	6	cd	cd	PROPN
ecletica-1352	196	7	complex	complex	NOUN
ecletica-1352	196	8	of	of	ADP
ecletica-1352	196	9	benzenetricarboxylates	benzenetricarboxylate	NOUN
ecletica-1352	196	10	was	be	AUX
ecletica-1352	196	11	observed	observe	VERB
ecletica-1352	196	12	to	to	PART
ecletica-1352	196	13	have	have	VERB
ecletica-1352	196	14	a	a	DET
ecletica-1352	196	15	low	low	ADJ
ecletica-1352	196	16	chemical	chemical	NOUN
ecletica-1352	196	17	potential	potential	ADJ
ecletica-1352	196	18	value	value	NOUN
ecletica-1352	196	19	of	of	ADP
ecletica-1352	196	20	–	–	PUNCT
ecletica-1352	196	21	6.23	6.23	NUM
ecletica-1352	196	22	ev	ev	NOUN
ecletica-1352	196	23	,	,	PUNCT
ecletica-1352	196	24	which	which	PRON
ecletica-1352	196	25	could	could	AUX
ecletica-1352	196	26	be	be	AUX
ecletica-1352	196	27	accounted	account	VERB
ecletica-1352	196	28	on	on	ADP
ecletica-1352	196	29	the	the	DET
ecletica-1352	196	30	fact	fact	NOUN
ecletica-1352	196	31	of	of	ADP
ecletica-1352	196	32	the	the	DET
ecletica-1352	196	33	loosely	loosely	ADV
ecletica-1352	196	34	bonded	bond	VERB
ecletica-1352	196	35	electron	electron	NOUN
ecletica-1352	196	36	in	in	ADP
ecletica-1352	196	37	the	the	DET
ecletica-1352	196	38	fermi	fermi	NOUN
ecletica-1352	196	39	energy	energy	NOUN
ecletica-1352	196	40	level	level	NOUN
ecletica-1352	196	41	and	and	CCONJ
ecletica-1352	196	42	,	,	PUNCT
ecletica-1352	196	43	hence	hence	ADV
ecletica-1352	196	44	,	,	PUNCT
ecletica-1352	196	45	was	be	AUX
ecletica-1352	196	46	observed	observe	VERB
ecletica-1352	196	47	to	to	PART
ecletica-1352	196	48	have	have	VERB
ecletica-1352	196	49	a	a	DET
ecletica-1352	196	50	greater	great	ADJ
ecletica-1352	196	51	electron	electron	NOUN
ecletica-1352	196	52	accepting	accept	VERB
ecletica-1352	196	53	power	power	NOUN
ecletica-1352	196	54	.	.	PUNCT
ecletica-1352	197	1	the	the	DET
ecletica-1352	197	2	small	small	ADJ
ecletica-1352	197	3	energy	energy	NOUN
ecletica-1352	197	4	gap	gap	NOUN
ecletica-1352	197	5	(	(	PUNCT
ecletica-1352	197	6	0.3322	0.3322	NUM
ecletica-1352	197	7	ev	ev	PRON
ecletica-1352	197	8	)	)	PUNCT
ecletica-1352	197	9	indicates	indicate	VERB
ecletica-1352	197	10	possible	possible	ADJ
ecletica-1352	197	11	excitation	excitation	NOUN
ecletica-1352	197	12	of	of	ADP
ecletica-1352	197	13	electrons	electron	NOUN
ecletica-1352	197	14	from	from	ADP
ecletica-1352	197	15	homo	homo	NOUN
ecletica-1352	197	16	to	to	ADP
ecletica-1352	197	17	lumo	lumo	NOUN
ecletica-1352	197	18	,	,	PUNCT
ecletica-1352	197	19	hence	hence	ADV
ecletica-1352	197	20	low	low	ADJ
ecletica-1352	197	21	stability	stability	NOUN
ecletica-1352	197	22	of	of	ADP
ecletica-1352	197	23	the	the	DET
ecletica-1352	197	24	complex	complex	NOUN
ecletica-1352	197	25	.	.	PUNCT
ecletica-1352	198	1	three	three	NUM
ecletica-1352	198	2	major	major	ADJ
ecletica-1352	198	3	transitions	transition	NOUN
ecletica-1352	198	4	:	:	PUNCT
ecletica-1352	198	5	π	π	X
ecletica-1352	198	6	*	*	PUNCT
ecletica-1352	198	7	→	→	SYM
ecletica-1352	198	8	π	π	X
ecletica-1352	198	9	*	*	NOUN
ecletica-1352	198	10	,	,	PUNCT
ecletica-1352	198	11	lp	lp	PROPN
ecletica-1352	198	12	*	*	PUNCT
ecletica-1352	198	13	→	→	PUNCT
ecletica-1352	198	14	σ	σ	PROPN
ecletica-1352	198	15	*	*	PROPN
ecletica-1352	198	16	and	and	CCONJ
ecletica-1352	198	17	lp	lp	PROPN
ecletica-1352	198	18	→	→	SYM
ecletica-1352	198	19	lp	lp	NOUN
ecletica-1352	198	20	*	*	PROPN
ecletica-1352	198	21	were	be	AUX
ecletica-1352	198	22	observed	observe	VERB
ecletica-1352	198	23	to	to	PART
ecletica-1352	198	24	have	have	VERB
ecletica-1352	198	25	the	the	DET
ecletica-1352	198	26	major	major	ADJ
ecletica-1352	198	27	contribution	contribution	NOUN
ecletica-1352	198	28	in	in	ADP
ecletica-1352	198	29	this	this	DET
ecletica-1352	198	30	study	study	NOUN
ecletica-1352	198	31	.	.	PUNCT
ecletica-1352	199	1	from	from	ADP
ecletica-1352	199	2	molecular	molecular	ADJ
ecletica-1352	199	3	docking	docking	NOUN
ecletica-1352	199	4	analysis	analysis	NOUN
ecletica-1352	199	5	,	,	PUNCT
ecletica-1352	199	6	the	the	DET
ecletica-1352	199	7	proposed	propose	VERB
ecletica-1352	199	8	complex	complex	NOUN
ecletica-1352	199	9	[	[	X
ecletica-1352	199	10	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	199	11	was	be	AUX
ecletica-1352	199	12	observed	observe	VERB
ecletica-1352	199	13	to	to	PART
ecletica-1352	199	14	have	have	VERB
ecletica-1352	199	15	better	well	ADJ
ecletica-1352	199	16	average	average	ADJ
ecletica-1352	199	17	binding	bind	VERB
ecletica-1352	199	18	score	score	NOUN
ecletica-1352	199	19	and	and	CCONJ
ecletica-1352	199	20	interesting	interesting	ADJ
ecletica-1352	199	21	number	number	NOUN
ecletica-1352	199	22	of	of	ADP
ecletica-1352	199	23	hydrogen	hydrogen	NOUN
ecletica-1352	199	24	bond	bond	NOUN
ecletica-1352	199	25	,	,	PUNCT
ecletica-1352	199	26	which	which	PRON
ecletica-1352	199	27	determines	determine	VERB
ecletica-1352	199	28	the	the	DET
ecletica-1352	199	29	activeness	activeness	NOUN
ecletica-1352	199	30	of	of	ADP
ecletica-1352	199	31	the	the	DET
ecletica-1352	199	32	proposed	propose	VERB
ecletica-1352	199	33	antimicrobial	antimicrobial	ADJ
ecletica-1352	199	34	drug	drug	NOUN
ecletica-1352	199	35	candidate	candidate	NOUN
ecletica-1352	199	36	.	.	PUNCT
ecletica-1352	200	1	the	the	DET
ecletica-1352	200	2	complex	complex	NOUN
ecletica-1352	200	3	[	[	X
ecletica-1352	200	4	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	200	5	was	be	AUX
ecletica-1352	200	6	docked	dock	VERB
ecletica-1352	200	7	with	with	ADP
ecletica-1352	200	8	the	the	DET
ecletica-1352	200	9	receptor	receptor	NOUN
ecletica-1352	200	10	proteins	protein	NOUN
ecletica-1352	200	11	1d7u	1d7u	NUM
ecletica-1352	200	12	and	and	CCONJ
ecletica-1352	200	13	2xcs	2xcs	NUM
ecletica-1352	200	14	and	and	CCONJ
ecletica-1352	200	15	observation	observation	NOUN
ecletica-1352	200	16	have	have	VERB
ecletica-1352	200	17	it	it	PRON
ecletica-1352	200	18	that	that	SCONJ
ecletica-1352	200	19	the	the	DET
ecletica-1352	200	20	complex	complex	NOUN
ecletica-1352	200	21	fits	fit	VERB
ecletica-1352	200	22	perfectly	perfectly	ADV
ecletica-1352	200	23	at	at	ADP
ecletica-1352	200	24	the	the	DET
ecletica-1352	200	25	active	active	ADJ
ecletica-1352	200	26	site	site	NOUN
ecletica-1352	200	27	of	of	ADP
ecletica-1352	200	28	proteins	protein	NOUN
ecletica-1352	200	29	1d7u	1d7u	NUM
ecletica-1352	200	30	and	and	CCONJ
ecletica-1352	200	31	2xcs	2xcs	PROPN
ecletica-1352	200	32	hence	hence	ADV
ecletica-1352	200	33	shows	show	VERB
ecletica-1352	200	34	the	the	DET
ecletica-1352	200	35	better	well	ADV
ecletica-1352	200	36	binding	bind	VERB
ecletica-1352	200	37	affinity	affinity	NOUN
ecletica-1352	200	38	and	and	CCONJ
ecletica-1352	200	39	efficacy	efficacy	NOUN
ecletica-1352	200	40	of	of	ADP
ecletica-1352	200	41	[	[	X
ecletica-1352	200	42	cd(btc)(h2o)2]n	cd(btc)(h2o)2]n	PROPN
ecletica-1352	200	43	as	as	ADP
ecletica-1352	200	44	potent	potent	ADJ
ecletica-1352	200	45	antimicrobial	antimicrobial	ADJ
ecletica-1352	200	46	drug	drug	NOUN
ecletica-1352	200	47	.	.	PUNCT
ecletica-1352	201	1	authors	author	NOUN
ecletica-1352	201	2	’	’	PART
ecletica-1352	201	3	contribution	contribution	NOUN
ecletica-1352	201	4	conceptualization	conceptualization	NOUN
ecletica-1352	201	5	:	:	PUNCT
ecletica-1352	201	6	bassey	bassey	NOUN
ecletica-1352	201	7	,	,	PUNCT
ecletica-1352	201	8	e.	e.	PROPN
ecletica-1352	201	9	i.	i.	PROPN
ecletica-1352	201	10	data	data	PROPN
ecletica-1352	201	11	curation	curation	PROPN
ecletica-1352	201	12	:	:	PUNCT
ecletica-1352	202	1	ekpenyong	ekpenyong	PROPN
ecletica-1352	202	2	,	,	PUNCT
ecletica-1352	202	3	e.	e.	PROPN
ecletica-1352	202	4	e.	e.	PROPN
ecletica-1352	203	1	formal	formal	ADJ
ecletica-1352	203	2	analysis	analysis	NOUN
ecletica-1352	203	3	:	:	PUNCT
ecletica-1352	203	4	ekpenyong	ekpenyong	PROPN
ecletica-1352	203	5	,	,	PUNCT
ecletica-1352	203	6	e.	e.	PROPN
ecletica-1352	203	7	e.	e.	PROPN
ecletica-1352	203	8	funding	funding	PROPN
ecletica-1352	203	9	acquisition	acquisition	NOUN
ecletica-1352	203	10	:	:	PUNCT
ecletica-1352	203	11	not	not	PART
ecletica-1352	203	12	applicable	applicable	ADJ
ecletica-1352	203	13	investigation	investigation	NOUN
ecletica-1352	203	14	:	:	PUNCT
ecletica-1352	204	1	ita	ita	PROPN
ecletica-1352	204	2	,	,	PUNCT
ecletica-1352	204	3	i.	i.	PROPN
ecletica-1352	204	4	t.	t.	PROPN
ecletica-1352	204	5	methodology	methodology	PROPN
ecletica-1352	204	6	:	:	PUNCT
ecletica-1352	204	7	gber	gber	ADJ
ecletica-1352	204	8	,	,	PUNCT
ecletica-1352	204	9	t.	t.	PROPN
ecletica-1352	204	10	e.	e.	PROPN
ecletica-1352	204	11	project	project	PROPN
ecletica-1352	204	12	administration	administration	PROPN
ecletica-1352	204	13	:	:	PUNCT
ecletica-1352	204	14	gber	gber	PROPN
ecletica-1352	204	15	,	,	PUNCT
ecletica-1352	204	16	t.	t.	PROPN
ecletica-1352	204	17	e.	e.	PROPN
ecletica-1352	204	18	resources	resources	PROPN
ecletica-1352	204	19	:	:	PUNCT
ecletica-1352	205	1	benjamin	benjamin	PROPN
ecletica-1352	205	2	,	,	PUNCT
ecletica-1352	205	3	i.	i.	PROPN
ecletica-1352	205	4	;	;	PUNCT
ecletica-1352	205	5	bassey	bassey	PROPN
ecletica-1352	205	6	,	,	PUNCT
ecletica-1352	205	7	e.	e.	PROPN
ecletica-1352	205	8	i.	i.	PROPN
ecletica-1352	205	9	software	software	PROPN
ecletica-1352	205	10	:	:	PUNCT
ecletica-1352	205	11	not	not	PART
ecletica-1352	205	12	applicable	applicable	ADJ
ecletica-1352	205	13	supervision	supervision	NOUN
ecletica-1352	205	14	:	:	PUNCT
ecletica-1352	205	15	bassey	bassey	NOUN
ecletica-1352	205	16	,	,	PUNCT
ecletica-1352	205	17	e.	e.	PROPN
ecletica-1352	205	18	i.	i.	PROPN
ecletica-1352	205	19	validation	validation	PROPN
ecletica-1352	205	20	:	:	PUNCT
ecletica-1352	205	21	edet	edet	NOUN
ecletica-1352	205	22	,	,	PUNCT
ecletica-1352	205	23	h.	h.	PROPN
ecletica-1352	205	24	o.	o.	PROPN
ecletica-1352	205	25	visualization	visualization	PROPN
ecletica-1352	205	26	:	:	PUNCT
ecletica-1352	205	27	benjamin	benjamin	PROPN
ecletica-1352	205	28	,	,	PUNCT
ecletica-1352	205	29	i.	i.	PROPN
ecletica-1352	205	30	writing	writing	NOUN
ecletica-1352	205	31	–	–	PUNCT
ecletica-1352	205	32	original	original	ADJ
ecletica-1352	205	33	draft	draft	NOUN
ecletica-1352	205	34	:	:	PUNCT
ecletica-1352	205	35	ita	ita	PROPN
ecletica-1352	205	36	,	,	PUNCT
ecletica-1352	205	37	i.	i.	PROPN
ecletica-1352	205	38	t.	t.	PROPN
ecletica-1352	205	39	writing	writing	NOUN
ecletica-1352	205	40	–	–	PUNCT
ecletica-1352	205	41	review	review	NOUN
ecletica-1352	205	42	&	&	CCONJ
ecletica-1352	205	43	editing	editing	NOUN
ecletica-1352	205	44	:	:	PUNCT
ecletica-1352	205	45	edet	edet	NOUN
ecletica-1352	205	46	,	,	PUNCT
ecletica-1352	205	47	h.	h.	PROPN
ecletica-1352	205	48	o.	o.	PROPN
ecletica-1352	205	49	data	data	PROPN
ecletica-1352	205	50	availability	availability	NOUN
ecletica-1352	205	51	statement	statement	NOUN
ecletica-1352	205	52	all	all	DET
ecletica-1352	205	53	data	datum	NOUN
ecletica-1352	205	54	sets	set	NOUN
ecletica-1352	205	55	generated	generate	VERB
ecletica-1352	205	56	and	and	CCONJ
ecletica-1352	205	57	analysed	analyse	VERB
ecletica-1352	205	58	in	in	ADP
ecletica-1352	205	59	the	the	DET
ecletica-1352	205	60	current	current	ADJ
ecletica-1352	205	61	study	study	NOUN
ecletica-1352	205	62	are	be	AUX
ecletica-1352	205	63	presented	present	VERB
ecletica-1352	205	64	in	in	ADP
ecletica-1352	205	65	the	the	DET
ecletica-1352	205	66	manuscript	manuscript	NOUN
ecletica-1352	205	67	.	.	PUNCT
ecletica-1352	206	1	funding	funding	NOUN
ecletica-1352	206	2	not	not	PART
ecletica-1352	206	3	applicable	applicable	ADJ
ecletica-1352	206	4	.	.	PUNCT
ecletica-1352	207	1	acknowledgments	acknowledgment	NOUN
ecletica-1352	207	2	the	the	DET
ecletica-1352	207	3	center	center	NOUN
ecletica-1352	207	4	for	for	ADP
ecletica-1352	207	5	high	high	ADJ
ecletica-1352	207	6	performance	performance	NOUN
ecletica-1352	207	7	computing	computing	NOUN
ecletica-1352	207	8	(	(	PUNCT
ecletica-1352	207	9	chpc	chpc	NOUN
ecletica-1352	207	10	)	)	PUNCT
ecletica-1352	207	11	,	,	PUNCT
ecletica-1352	207	12	south	south	PROPN
ecletica-1352	207	13	africa	africa	PROPN
ecletica-1352	207	14	is	be	AUX
ecletica-1352	207	15	gratefully	gratefully	ADV
ecletica-1352	207	16	acknowledged	acknowledge	VERB
ecletica-1352	207	17	for	for	ADP
ecletica-1352	207	18	providing	provide	VERB
ecletica-1352	207	19	computational	computational	ADJ
ecletica-1352	207	20	resources	resource	NOUN
ecletica-1352	207	21	for	for	ADP
ecletica-1352	207	22	this	this	DET
ecletica-1352	207	23	project	project	NOUN
ecletica-1352	207	24	.	.	PUNCT
ecletica-1352	208	1	references	reference	NOUN
ecletica-1352	208	2	agwupuye	agwupuye	PROPN
ecletica-1352	208	3	,	,	PUNCT
ecletica-1352	208	4	j.	j.	PROPN
ecletica-1352	208	5	a.	a.	PROPN
ecletica-1352	208	6	;	;	PUNCT
ecletica-1352	208	7	louis	louis	PROPN
ecletica-1352	208	8	,	,	PUNCT
ecletica-1352	208	9	h.	h.	PROPN
ecletica-1352	208	10	;	;	PUNCT
ecletica-1352	208	11	unimuke	unimuke	NOUN
ecletica-1352	208	12	,	,	PUNCT
ecletica-1352	208	13	t.	t.	PROPN
ecletica-1352	208	14	o.	o.	PROPN
ecletica-1352	208	15	;	;	PUNCT
ecletica-1352	208	16	david	david	PROPN
ecletica-1352	208	17	,	,	PUNCT
ecletica-1352	208	18	p.	p.	PROPN
ecletica-1352	208	19	;	;	PUNCT
ecletica-1352	208	20	ubana	ubana	PROPN
ecletica-1352	208	21	,	,	PUNCT
ecletica-1352	208	22	e.	e.	PROPN
ecletica-1352	208	23	i.	i.	PROPN
ecletica-1352	208	24	;	;	PUNCT
ecletica-1352	208	25	moshood	moshood	PROPN
ecletica-1352	208	26	,	,	PUNCT
ecletica-1352	208	27	y.	y.	PROPN
ecletica-1352	208	28	l.	l.	PROPN
ecletica-1352	208	29	electronic	electronic	ADJ
ecletica-1352	208	30	structure	structure	NOUN
ecletica-1352	208	31	investigation	investigation	NOUN
ecletica-1352	208	32	of	of	ADP
ecletica-1352	208	33	the	the	DET
ecletica-1352	208	34	stability	stability	NOUN
ecletica-1352	208	35	,	,	PUNCT
ecletica-1352	208	36	reactivity	reactivity	NOUN
ecletica-1352	208	37	,	,	PUNCT
ecletica-1352	208	38	nbo	nbo	PROPN
ecletica-1352	208	39	analysis	analysis	NOUN
ecletica-1352	208	40	,	,	PUNCT
ecletica-1352	208	41	thermodynamics	thermodynamic	NOUN
ecletica-1352	208	42	,	,	PUNCT
ecletica-1352	208	43	and	and	CCONJ
ecletica-1352	208	44	the	the	DET
ecletica-1352	208	45	nature	nature	NOUN
ecletica-1352	208	46	of	of	ADP
ecletica-1352	208	47	the	the	DET
ecletica-1352	208	48	interactions	interaction	NOUN
ecletica-1352	208	49	in	in	ADP
ecletica-1352	208	50	methylsubstituted	methylsubstituted	ADJ
ecletica-1352	208	51	imidazolium	imidazolium	NOUN
ecletica-1352	208	52	-	-	PUNCT
ecletica-1352	208	53	based	base	VERB
ecletica-1352	208	54	ionic	ionic	ADJ
ecletica-1352	208	55	liquids	liquid	NOUN
ecletica-1352	208	56	.	.	PUNCT
ecletica-1352	209	1	j.	j.	PROPN
ecletica-1352	209	2	mol	mol	PROPN
ecletica-1352	209	3	.	.	PROPN
ecletica-1352	209	4	liq	liq	PROPN
ecletica-1352	209	5	.	.	PUNCT
ecletica-1352	210	1	2021a	2021a	NUM
ecletica-1352	210	2	,	,	PUNCT
ecletica-1352	210	3	337	337	NUM
ecletica-1352	210	4	,	,	PUNCT
ecletica-1352	210	5	116458	116458	NUM
ecletica-1352	210	6	.	.	PUNCT
ecletica-1352	211	1	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	211	2	agwupuye	agwupuye	PROPN
ecletica-1352	211	3	,	,	PUNCT
ecletica-1352	211	4	j.	j.	PROPN
ecletica-1352	211	5	a.	a.	PROPN
ecletica-1352	211	6	;	;	PUNCT
ecletica-1352	211	7	neji	neji	PROPN
ecletica-1352	211	8	,	,	PUNCT
ecletica-1352	211	9	p.	p.	NOUN
ecletica-1352	211	10	a.	a.	NOUN
ecletica-1352	211	11	;	;	PUNCT
ecletica-1352	211	12	louis	louis	PROPN
ecletica-1352	211	13	,	,	PUNCT
ecletica-1352	211	14	h.	h.	PROPN
ecletica-1352	211	15	;	;	PUNCT
ecletica-1352	211	16	odey	odey	PROPN
ecletica-1352	211	17	,	,	PUNCT
ecletica-1352	211	18	j.	j.	PROPN
ecletica-1352	211	19	o.	o.	PROPN
ecletica-1352	211	20	;	;	PUNCT
ecletica-1352	211	21	unimuke	unimuke	NOUN
ecletica-1352	211	22	,	,	PUNCT
ecletica-1352	211	23	t.	t.	PROPN
ecletica-1352	211	24	o.	o.	PROPN
ecletica-1352	211	25	;	;	PUNCT
ecletica-1352	211	26	bisiong	bisiong	PROPN
ecletica-1352	211	27	,	,	PUNCT
ecletica-1352	211	28	e.	e.	PROPN
ecletica-1352	211	29	a.	a.	PROPN
ecletica-1352	211	30	;	;	PUNCT
ecletica-1352	211	31	eno	eno	PROPN
ecletica-1352	211	32	.	.	PUNCT
ecletica-1352	212	1	e.	e.	PROPN
ecletica-1352	212	2	a.	a.	PROPN
ecletica-1352	212	3	;	;	PUNCT
ecletica-1352	212	4	utsu	utsu	NOUN
ecletica-1352	212	5	,	,	PUNCT
ecletica-1352	212	6	p.	p.	NOUN
ecletica-1352	212	7	m.	m.	NOUN
ecletica-1352	212	8	;	;	PUNCT
ecletica-1352	212	9	ntui	ntui	PROPN
ecletica-1352	212	10	,	,	PUNCT
ecletica-1352	212	11	t.	t.	PROPN
ecletica-1352	212	12	n.	n.	PROPN
ecletica-1352	212	13	investigation	investigation	NOUN
ecletica-1352	212	14	on	on	ADP
ecletica-1352	212	15	electronic	electronic	ADJ
ecletica-1352	212	16	structure	structure	NOUN
ecletica-1352	212	17	,	,	PUNCT
ecletica-1352	212	18	vibrational	vibrational	ADJ
ecletica-1352	212	19	spectra	spectra	NOUN
ecletica-1352	212	20	,	,	PUNCT
ecletica-1352	212	21	nbo	nbo	PROPN
ecletica-1352	212	22	analysis	analysis	NOUN
ecletica-1352	212	23	,	,	PUNCT
ecletica-1352	212	24	and	and	CCONJ
ecletica-1352	212	25	molecular	molecular	ADJ
ecletica-1352	212	26	docking	docking	NOUN
ecletica-1352	212	27	studies	study	NOUN
ecletica-1352	212	28	of	of	ADP
ecletica-1352	212	29	aflatoxins	aflatoxin	NOUN
ecletica-1352	212	30	and	and	CCONJ
ecletica-1352	212	31	selected	select	VERB
ecletica-1352	212	32	emerging	emerge	VERB
ecletica-1352	212	33	mycotoxins	mycotoxin	NOUN
ecletica-1352	212	34	against	against	ADP
ecletica-1352	212	35	wild	wild	ADJ
ecletica-1352	212	36	-	-	PUNCT
ecletica-1352	212	37	type	type	NOUN
ecletica-1352	212	38	androgen	androgen	NOUN
ecletica-1352	212	39	receptor	receptor	NOUN
ecletica-1352	212	40	.	.	PUNCT
ecletica-1352	213	1	heliyon	heliyon	NOUN
ecletica-1352	213	2	.	.	PUNCT
ecletica-1352	214	1	2021b	2021b	NUM
ecletica-1352	214	2	,	,	PUNCT
ecletica-1352	214	3	7	7	NUM
ecletica-1352	214	4	(	(	PUNCT
ecletica-1352	214	5	7	7	NUM
ecletica-1352	214	6	)	)	PUNCT
ecletica-1352	214	7	,	,	PUNCT
ecletica-1352	214	8	e07544	e07544	PROPN
ecletica-1352	214	9	.	.	PUNCT
ecletica-1352	215	1	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	PROPN
ecletica-1352	215	2	andrade	andrade	PROPN
ecletica-1352	215	3	,	,	PUNCT
ecletica-1352	215	4	e.	e.	PROPN
ecletica-1352	215	5	l.	l.	PROPN
ecletica-1352	215	6	;	;	PUNCT
ecletica-1352	215	7	bento	bento	PROPN
ecletica-1352	215	8	,	,	PUNCT
ecletica-1352	215	9	a.	a.	PROPN
ecletica-1352	215	10	f.	f.	PROPN
ecletica-1352	215	11	;	;	PUNCT
ecletica-1352	215	12	cavalli	cavalli	PROPN
ecletica-1352	215	13	,	,	PUNCT
ecletica-1352	215	14	j.	j.	PROPN
ecletica-1352	215	15	;	;	PUNCT
ecletica-1352	215	16	oliveira	oliveira	PROPN
ecletica-1352	215	17	,	,	PUNCT
ecletica-1352	215	18	s.	s.	PROPN
ecletica-1352	215	19	k.	k.	PROPN
ecletica-1352	215	20	;	;	PUNCT
ecletica-1352	215	21	schwanke	schwanke	PROPN
ecletica-1352	215	22	,	,	PUNCT
ecletica-1352	215	23	r.	r.	PROPN
ecletica-1352	215	24	c.	c.	PROPN
ecletica-1352	215	25	;	;	PUNCT
ecletica-1352	215	26	siqueira	siqueira	PROPN
ecletica-1352	215	27	,	,	PUNCT
ecletica-1352	215	28	j.	j.	PROPN
ecletica-1352	215	29	m.	m.	PROPN
ecletica-1352	215	30	;	;	PUNCT
ecletica-1352	215	31	freitas	freitas	PROPN
ecletica-1352	215	32	,	,	PUNCT
ecletica-1352	215	33	c.	c.	PROPN
ecletica-1352	215	34	s.	s.	PROPN
ecletica-1352	215	35	;	;	PUNCT
ecletica-1352	215	36	marcon	marcon	PROPN
ecletica-1352	215	37	,	,	PUNCT
ecletica-1352	215	38	r.	r.	PROPN
ecletica-1352	215	39	;	;	PUNCT
ecletica-1352	215	40	calixto	calixto	PROPN
ecletica-1352	215	41	,	,	PUNCT
ecletica-1352	215	42	j.	j.	PROPN
ecletica-1352	215	43	b.	b.	PROPN
ecletica-1352	215	44	non	non	ADJ
ecletica-1352	215	45	-	-	ADJ
ecletica-1352	215	46	clinical	clinical	ADJ
ecletica-1352	215	47	studies	study	NOUN
ecletica-1352	215	48	in	in	ADP
ecletica-1352	215	49	the	the	DET
ecletica-1352	215	50	process	process	NOUN
ecletica-1352	215	51	of	of	ADP
ecletica-1352	215	52	new	new	ADJ
ecletica-1352	215	53	drug	drug	NOUN
ecletica-1352	215	54	development	development	NOUN
ecletica-1352	215	55	-	-	PUNCT
ecletica-1352	215	56	part	part	NOUN
ecletica-1352	215	57	ii	ii	PROPN
ecletica-1352	215	58	:	:	PUNCT
ecletica-1352	215	59	good	good	ADJ
ecletica-1352	215	60	laboratory	laboratory	NOUN
ecletica-1352	215	61	practice	practice	NOUN
ecletica-1352	215	62	,	,	PUNCT
ecletica-1352	215	63	metabolism	metabolism	NOUN
ecletica-1352	215	64	,	,	PUNCT
ecletica-1352	215	65	pharmacokinetics	pharmacokinetic	NOUN
ecletica-1352	215	66	,	,	PUNCT
ecletica-1352	215	67	safety	safety	NOUN
ecletica-1352	215	68	and	and	CCONJ
ecletica-1352	215	69	dose	dose	NOUN
ecletica-1352	215	70	translation	translation	NOUN
ecletica-1352	215	71	to	to	ADP
ecletica-1352	215	72	clinical	clinical	ADJ
ecletica-1352	215	73	studies	study	NOUN
ecletica-1352	215	74	.	.	PUNCT
ecletica-1352	216	1	braz	braz	PROPN
ecletica-1352	216	2	.	.	PUNCT
ecletica-1352	217	1	j.	j.	PROPN
ecletica-1352	217	2	med	med	PROPN
ecletica-1352	217	3	.	.	PUNCT
ecletica-1352	218	1	biol	biol	PROPN
ecletica-1352	218	2	.	.	PUNCT
ecletica-1352	219	1	res	re	NOUN
ecletica-1352	219	2	.	.	PROPN
ecletica-1352	219	3	2016	2016	NUM
ecletica-1352	219	4	,	,	PUNCT
ecletica-1352	219	5	49	49	NUM
ecletica-1352	219	6	(	(	PUNCT
ecletica-1352	219	7	12	12	NUM
ecletica-1352	219	8	)	)	PUNCT
ecletica-1352	220	1	,	,	PUNCT
ecletica-1352	220	2	e5646	e5646	PROPN
ecletica-1352	220	3	.	.	PUNCT
ecletica-1352	221	1	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	221	2	balaban	balaban	PROPN
ecletica-1352	221	3	,	,	PUNCT
ecletica-1352	221	4	n.	n.	PROPN
ecletica-1352	221	5	q.	q.	PROPN
ecletica-1352	221	6	;	;	PUNCT
ecletica-1352	221	7	helaine	helaine	PROPN
ecletica-1352	221	8	,	,	PUNCT
ecletica-1352	221	9	s.	s.	PROPN
ecletica-1352	221	10	;	;	PUNCT
ecletica-1352	221	11	lewis	lewis	PROPN
ecletica-1352	221	12	,	,	PUNCT
ecletica-1352	221	13	k.	k.	PROPN
ecletica-1352	221	14	;	;	PUNCT
ecletica-1352	221	15	ackermann	ackermann	PROPN
ecletica-1352	221	16	,	,	PUNCT
ecletica-1352	221	17	m.	m.	NOUN
ecletica-1352	221	18	;	;	PUNCT
ecletica-1352	221	19	aldridge	aldridge	PROPN
ecletica-1352	221	20	,	,	PUNCT
ecletica-1352	221	21	b.	b.	PROPN
ecletica-1352	221	22	;	;	PUNCT
ecletica-1352	221	23	andersson	andersson	PROPN
ecletica-1352	221	24	,	,	PUNCT
ecletica-1352	221	25	d.	d.	PROPN
ecletica-1352	221	26	i.	i.	PROPN
ecletica-1352	221	27	;	;	PUNCT
ecletica-1352	221	28	brynildsen	brynildsen	PROPN
ecletica-1352	221	29	,	,	PUNCT
ecletica-1352	221	30	m.	m.	NOUN
ecletica-1352	221	31	p.	p.	NOUN
ecletica-1352	221	32	;	;	PUNCT
ecletica-1352	221	33	bumann	bumann	PROPN
ecletica-1352	221	34	,	,	PUNCT
ecletica-1352	221	35	d.	d.	PROPN
ecletica-1352	221	36	;	;	PUNCT
ecletica-1352	221	37	camilli	camilli	PROPN
ecletica-1352	221	38	,	,	PUNCT
ecletica-1352	221	39	a.	a.	PROPN
ecletica-1352	221	40	;	;	PUNCT
ecletica-1352	221	41	collins	collins	PROPN
ecletica-1352	221	42	,	,	PUNCT
ecletica-1352	221	43	j.	j.	PROPN
ecletica-1352	221	44	j.	j.	PROPN
ecletica-1352	221	45	;	;	PUNCT
ecletica-1352	221	46	dehio	dehio	PROPN
ecletica-1352	221	47	,	,	PUNCT
ecletica-1352	221	48	c.	c.	NOUN
ecletica-1352	221	49	;	;	PUNCT
ecletica-1352	221	50	fortune	fortune	PROPN
ecletica-1352	221	51	,	,	PUNCT
ecletica-1352	221	52	s.	s.	PROPN
ecletica-1352	221	53	;	;	PUNCT
ecletica-1352	221	54	ghigo	ghigo	PROPN
ecletica-1352	221	55	,	,	PUNCT
ecletica-1352	221	56	j.-m	j.-m	PROPN
ecletica-1352	221	57	.	.	PUNCT
ecletica-1352	221	58	;	;	PUNCT
ecletica-1352	222	1	hardt	hardt	PROPN
ecletica-1352	222	2	,	,	PUNCT
ecletica-1352	222	3	w.-d	w.-d	PROPN
ecletica-1352	222	4	.	.	PUNCT
ecletica-1352	222	5	;	;	PUNCT
ecletica-1352	222	6	harms	harm	NOUN
ecletica-1352	222	7	,	,	PUNCT
ecletica-1352	222	8	a.	a.	NOUN
ecletica-1352	222	9	;	;	PUNCT
ecletica-1352	222	10	heinemann	heinemann	PROPN
ecletica-1352	222	11	,	,	PUNCT
ecletica-1352	222	12	m.	m.	NOUN
ecletica-1352	222	13	;	;	PUNCT
ecletica-1352	222	14	hung	hung	PROPN
ecletica-1352	222	15	,	,	PUNCT
ecletica-1352	222	16	d.	d.	PROPN
ecletica-1352	222	17	t.	t.	PROPN
ecletica-1352	222	18	;	;	PUNCT
ecletica-1352	222	19	jenal	jenal	PROPN
ecletica-1352	222	20	,	,	PUNCT
ecletica-1352	222	21	u.	u.	PROPN
ecletica-1352	222	22	;	;	PUNCT
ecletica-1352	222	23	levin	levin	PROPN
ecletica-1352	222	24	,	,	PUNCT
ecletica-1352	222	25	b.	b.	PROPN
ecletica-1352	222	26	r.	r.	PROPN
ecletica-1352	222	27	;	;	PUNCT
ecletica-1352	222	28	michiels	michiel	NOUN
ecletica-1352	222	29	,	,	PUNCT
ecletica-1352	222	30	j.	j.	PROPN
ecletica-1352	222	31	;	;	PUNCT
ecletica-1352	222	32	storz	storz	PROPN
ecletica-1352	222	33	,	,	PUNCT
ecletica-1352	222	34	g.	g.	PROPN
ecletica-1352	222	35	;	;	PUNCT
ecletica-1352	222	36	tan	tan	PROPN
ecletica-1352	222	37	,	,	PUNCT
ecletica-1352	222	38	m.-w	m.-w	PROPN
ecletica-1352	222	39	.	.	PUNCT
ecletica-1352	222	40	;	;	PUNCT
ecletica-1352	222	41	tenson	tenson	NOUN
ecletica-1352	222	42	,	,	PUNCT
ecletica-1352	222	43	t.	t.	PROPN
ecletica-1352	222	44	;	;	PUNCT
ecletica-1352	222	45	van	van	PROPN
ecletica-1352	222	46	melderen	melderen	PROPN
ecletica-1352	222	47	,	,	PUNCT
ecletica-1352	222	48	l.	l.	PROPN
ecletica-1352	222	49	;	;	PUNCT
ecletica-1352	222	50	zinkernagel	zinkernagel	PROPN
ecletica-1352	222	51	,	,	PUNCT
ecletica-1352	222	52	a.	a.	NOUN
ecletica-1352	222	53	definitions	definition	NOUN
ecletica-1352	222	54	and	and	CCONJ
ecletica-1352	222	55	guidelines	guideline	NOUN
ecletica-1352	222	56	for	for	ADP
ecletica-1352	222	57	research	research	NOUN
ecletica-1352	222	58	on	on	ADP
ecletica-1352	222	59	antibiotic	antibiotic	ADJ
ecletica-1352	222	60	persistence	persistence	NOUN
ecletica-1352	222	61	.	.	PUNCT
ecletica-1352	223	1	nature	nature	NOUN
ecletica-1352	223	2	reviews	review	VERB
ecletica-1352	223	3	microbiology	microbiology	NOUN
ecletica-1352	223	4	.	.	PUNCT
ecletica-1352	224	1	2019	2019	NUM
ecletica-1352	224	2	,	,	PUNCT
ecletica-1352	224	3	17	17	NUM
ecletica-1352	224	4	(	(	PUNCT
ecletica-1352	224	5	7	7	NUM
ecletica-1352	224	6	)	)	PUNCT
ecletica-1352	224	7	,	,	PUNCT
ecletica-1352	224	8	441–448	441–448	NUM
ecletica-1352	224	9	.	.	PUNCT
ecletica-1352	225	1	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	2	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	225	3	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	225	4	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	225	5	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	225	6	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	225	7	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	225	8	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	225	9	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	225	10	https://doi.org/10.1016/j.molliq.2021.116458	https://doi.org/10.1016/j.molliq.2021.116458	ADJ
ecletica-1352	225	11	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	X
ecletica-1352	225	12	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	X
ecletica-1352	225	13	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	X
ecletica-1352	225	14	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	X
ecletica-1352	225	15	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	X
ecletica-1352	225	16	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	X
ecletica-1352	225	17	https://doi.org/10.1016/j.heliyon.2021.e07544	https://doi.org/10.1016/j.heliyon.2021.e07544	X
ecletica-1352	225	18	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	225	19	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	225	20	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	225	21	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	225	22	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	225	23	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	225	24	https://doi.org/10.1590/1414-431x20165646	https://doi.org/10.1590/1414-431x20165646	PROPN
ecletica-1352	225	25	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	26	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	27	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	28	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	29	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	30	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	31	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	32	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	33	https://doi.org/10.1038/s41579-019-0196-3	https://doi.org/10.1038/s41579-019-0196-3	NUM
ecletica-1352	225	34	original	original	ADJ
ecletica-1352	225	35	article	article	NOUN
ecletica-1352	225	36	revista.iq.unesp.br	revista.iq.unesp.br	VERB
ecletica-1352	225	37	48	48	NUM
ecletica-1352	225	38	eclética	eclética	PROPN
ecletica-1352	225	39	química	química	PROPN
ecletica-1352	225	40	journal	journal	PROPN
ecletica-1352	225	41	,	,	PUNCT
ecletica-1352	225	42	vol	vol	NOUN
ecletica-1352	225	43	.	.	PROPN
ecletica-1352	225	44	47	47	NUM
ecletica-1352	225	45	,	,	PUNCT
ecletica-1352	225	46	n.	n.	NOUN
ecletica-1352	225	47	4	4	NUM
ecletica-1352	225	48	,	,	PUNCT
ecletica-1352	225	49	2022	2022	NUM
ecletica-1352	225	50	,	,	PUNCT
ecletica-1352	225	51	37	37	NUM
ecletica-1352	225	52	-	-	SYM
ecletica-1352	225	53	50	50	NUM
ecletica-1352	225	54	issn	issn	NOUN
ecletica-1352	225	55	:	:	PUNCT
ecletica-1352	225	56	1678	1678	NUM
ecletica-1352	225	57	-	-	SYM
ecletica-1352	225	58	4618	4618	NUM
ecletica-1352	225	59	doi	doi	NOUN
ecletica-1352	225	60	:	:	PUNCT
ecletica-1352	225	61	10.26850/1678	10.26850/1678	NUM
ecletica-1352	225	62	-	-	PUNCT
ecletica-1352	225	63	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	225	64	-	-	PUNCT
ecletica-1352	225	65	50	50	NUM
ecletica-1352	225	66	bassey	bassey	NOUN
ecletica-1352	225	67	,	,	PUNCT
ecletica-1352	225	68	v.	v.	ADP
ecletica-1352	225	69	m.	m.	NOUN
ecletica-1352	225	70	;	;	PUNCT
ecletica-1352	225	71	apebende	apebende	PROPN
ecletica-1352	225	72	,	,	PUNCT
ecletica-1352	225	73	c.	c.	PROPN
ecletica-1352	225	74	g.	g.	PROPN
ecletica-1352	225	75	;	;	PUNCT
ecletica-1352	225	76	idante	idante	PROPN
ecletica-1352	225	77	,	,	PUNCT
ecletica-1352	225	78	p.	p.	PROPN
ecletica-1352	225	79	s.	s.	PROPN
ecletica-1352	225	80	;	;	PUNCT
ecletica-1352	225	81	louis	louis	PROPN
ecletica-1352	225	82	,	,	PUNCT
ecletica-1352	225	83	h.	h.	PROPN
ecletica-1352	225	84	;	;	PUNCT
ecletica-1352	225	85	emori	emori	PROPN
ecletica-1352	225	86	,	,	PUNCT
ecletica-1352	225	87	w.	w.	PROPN
ecletica-1352	225	88	;	;	PUNCT
ecletica-1352	225	89	cheng	cheng	PROPN
ecletica-1352	225	90	,	,	PUNCT
ecletica-1352	225	91	c.-r	c.-r	PROPN
ecletica-1352	225	92	.	.	PUNCT
ecletica-1352	225	93	;	;	PUNCT
ecletica-1352	225	94	agwupuye	agwupuye	PROPN
ecletica-1352	225	95	,	,	PUNCT
ecletica-1352	225	96	j.	j.	PROPN
ecletica-1352	225	97	a.	a.	PROPN
ecletica-1352	225	98	;	;	PUNCT
ecletica-1352	225	99	unimuke	unimuke	NOUN
ecletica-1352	225	100	,	,	PUNCT
ecletica-1352	225	101	t.	t.	PROPN
ecletica-1352	225	102	o.	o.	PROPN
ecletica-1352	225	103	;	;	PUNCT
ecletica-1352	225	104	wei	wei	PROPN
ecletica-1352	225	105	,	,	PUNCT
ecletica-1352	225	106	k.	k.	PROPN
ecletica-1352	225	107	;	;	PUNCT
ecletica-1352	225	108	asogwa	asogwa	PROPN
ecletica-1352	225	109	,	,	PUNCT
ecletica-1352	225	110	f.	f.	PROPN
ecletica-1352	225	111	c.	c.	PROPN
ecletica-1352	225	112	vibrational	vibrational	PROPN
ecletica-1352	225	113	characterization	characterization	NOUN
ecletica-1352	225	114	and	and	CCONJ
ecletica-1352	225	115	molecular	molecular	ADJ
ecletica-1352	225	116	electronic	electronic	ADJ
ecletica-1352	225	117	investigations	investigation	NOUN
ecletica-1352	225	118	of	of	ADP
ecletica-1352	225	119	2	2	NUM
ecletica-1352	225	120	-	-	PUNCT
ecletica-1352	225	121	acetyl-5methylfuran	acetyl-5methylfuran	ADV
ecletica-1352	225	122	using	use	VERB
ecletica-1352	225	123	ft	ft	PROPN
ecletica-1352	225	124	-	-	PUNCT
ecletica-1352	225	125	ir	ir	PROPN
ecletica-1352	225	126	,	,	PUNCT
ecletica-1352	225	127	ft	ft	NOUN
ecletica-1352	225	128	-	-	PUNCT
ecletica-1352	225	129	raman	raman	NOUN
ecletica-1352	225	130	,	,	PUNCT
ecletica-1352	225	131	uv	uv	NOUN
ecletica-1352	225	132	–	–	PUNCT
ecletica-1352	225	133	vis	vis	X
ecletica-1352	225	134	,	,	PUNCT
ecletica-1352	225	135	nmr	nmr	NOUN
ecletica-1352	225	136	,	,	PUNCT
ecletica-1352	225	137	and	and	CCONJ
ecletica-1352	225	138	dft	dft	PROPN
ecletica-1352	225	139	methods	method	NOUN
ecletica-1352	225	140	.	.	PUNCT
ecletica-1352	226	1	j.	j.	PROPN
ecletica-1352	226	2	fluoresc	fluoresc	PROPN
ecletica-1352	226	3	.	.	PUNCT
ecletica-1352	226	4	2022	2022	NUM
ecletica-1352	226	5	,	,	PUNCT
ecletica-1352	226	6	32	32	NUM
ecletica-1352	226	7	(	(	PUNCT
ecletica-1352	226	8	3	3	NUM
ecletica-1352	226	9	)	)	PUNCT
ecletica-1352	226	10	,	,	PUNCT
ecletica-1352	226	11	1005–1017	1005–1017	NUM
ecletica-1352	226	12	.	.	X
ecletica-1352	226	13	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	226	14	berman	berman	PROPN
ecletica-1352	226	15	,	,	PUNCT
ecletica-1352	226	16	h.	h.	PROPN
ecletica-1352	226	17	m.	m.	PROPN
ecletica-1352	226	18	;	;	PUNCT
ecletica-1352	226	19	battistuz	battistuz	PROPN
ecletica-1352	226	20	,	,	PUNCT
ecletica-1352	226	21	t.	t.	PROPN
ecletica-1352	226	22	;	;	PUNCT
ecletica-1352	226	23	bhat	bhat	PROPN
ecletica-1352	226	24	,	,	PUNCT
ecletica-1352	226	25	t.	t.	PROPN
ecletica-1352	226	26	n.	n.	PROPN
ecletica-1352	226	27	;	;	PUNCT
ecletica-1352	226	28	bluhm	bluhm	PROPN
ecletica-1352	226	29	,	,	PUNCT
ecletica-1352	226	30	w.	w.	PROPN
ecletica-1352	226	31	f.	f.	PROPN
ecletica-1352	226	32	;	;	PUNCT
ecletica-1352	226	33	bourne	bourne	NOUN
ecletica-1352	226	34	,	,	PUNCT
ecletica-1352	226	35	p.	p.	PROPN
ecletica-1352	226	36	e.	e.	PROPN
ecletica-1352	226	37	;	;	PUNCT
ecletica-1352	226	38	burkhardt	burkhardt	PROPN
ecletica-1352	226	39	,	,	PUNCT
ecletica-1352	226	40	k.	k.	PROPN
ecletica-1352	226	41	;	;	PUNCT
ecletica-1352	226	42	feng	feng	PROPN
ecletica-1352	226	43	,	,	PUNCT
ecletica-1352	226	44	z.	z.	PROPN
ecletica-1352	226	45	;	;	PUNCT
ecletica-1352	226	46	gilliland	gilliland	PROPN
ecletica-1352	226	47	,	,	PUNCT
ecletica-1352	226	48	g.	g.	PROPN
ecletica-1352	226	49	l.	l.	PROPN
ecletica-1352	226	50	;	;	PUNCT
ecletica-1352	226	51	iype	iype	NOUN
ecletica-1352	226	52	,	,	PUNCT
ecletica-1352	226	53	l.	l.	PROPN
ecletica-1352	226	54	;	;	PUNCT
ecletica-1352	226	55	jain	jain	PROPN
ecletica-1352	226	56	,	,	PUNCT
ecletica-1352	226	57	s.	s.	PROPN
ecletica-1352	226	58	;	;	PUNCT
ecletica-1352	226	59	fang	fang	X
ecletica-1352	226	60	,	,	PUNCT
ecletica-1352	226	61	p.	p.	NOUN
ecletica-1352	226	62	;	;	PUNCT
ecletica-1352	226	63	marvin	marvin	PROPN
ecletica-1352	226	64	,	,	PUNCT
ecletica-1352	226	65	j.	j.	PROPN
ecletica-1352	226	66	;	;	PUNCT
ecletica-1352	226	67	padilla	padilla	PROPN
ecletica-1352	226	68	,	,	PUNCT
ecletica-1352	226	69	d.	d.	PROPN
ecletica-1352	226	70	;	;	PUNCT
ecletica-1352	226	71	ravichandran	ravichandran	NOUN
ecletica-1352	226	72	,	,	PUNCT
ecletica-1352	226	73	v.	v.	PROPN
ecletica-1352	226	74	;	;	PUNCT
ecletica-1352	226	75	schneider	schneider	PROPN
ecletica-1352	226	76	,	,	PUNCT
ecletica-1352	226	77	b.	b.	PROPN
ecletica-1352	226	78	;	;	PUNCT
ecletica-1352	226	79	thanki	thanki	PROPN
ecletica-1352	226	80	,	,	PUNCT
ecletica-1352	226	81	n.	n.	NOUN
ecletica-1352	226	82	;	;	PUNCT
ecletica-1352	226	83	weissing	weissing	NOUN
ecletica-1352	226	84	,	,	PUNCT
ecletica-1352	226	85	h.	h.	PROPN
ecletica-1352	226	86	;	;	PUNCT
ecletica-1352	226	87	westbrook	westbrook	PROPN
ecletica-1352	226	88	,	,	PUNCT
ecletica-1352	226	89	d.	d.	PROPN
ecletica-1352	226	90	;	;	PUNCT
ecletica-1352	226	91	zardecki	zardecki	PROPN
ecletica-1352	226	92	,	,	PUNCT
ecletica-1352	226	93	c.	c.	PROPN
ecletica-1352	226	94	the	the	DET
ecletica-1352	226	95	protein	protein	NOUN
ecletica-1352	226	96	data	data	PROPN
ecletica-1352	226	97	bank	bank	PROPN
ecletica-1352	226	98	.	.	PUNCT
ecletica-1352	227	1	acta	acta	PROPN
ecletica-1352	227	2	cryst	cryst	PROPN
ecletica-1352	227	3	.	.	PUNCT
ecletica-1352	228	1	2002	2002	NUM
ecletica-1352	228	2	,	,	PUNCT
ecletica-1352	228	3	d58	d58	NOUN
ecletica-1352	228	4	(	(	PUNCT
ecletica-1352	228	5	6	6	NUM
ecletica-1352	228	6	)	)	PUNCT
ecletica-1352	228	7	,	,	PUNCT
ecletica-1352	228	8	899–907	899–907	NUM
ecletica-1352	228	9	.	.	PUNCT
ecletica-1352	229	1	https://doi.org/10.1107/s0907444902003451	https://doi.org/10.1107/s0907444902003451	NUM
ecletica-1352	229	2	bisong	bisong	NOUN
ecletica-1352	229	3	,	,	PUNCT
ecletica-1352	229	4	e.	e.	PROPN
ecletica-1352	229	5	a.	a.	PROPN
ecletica-1352	229	6	;	;	PUNCT
ecletica-1352	229	7	louis	louis	PROPN
ecletica-1352	229	8	,	,	PUNCT
ecletica-1352	229	9	h.	h.	PROPN
ecletica-1352	229	10	;	;	PUNCT
ecletica-1352	229	11	unimuke	unimuke	NOUN
ecletica-1352	229	12	,	,	PUNCT
ecletica-1352	229	13	t.	t.	PROPN
ecletica-1352	229	14	o.	o.	PROPN
ecletica-1352	229	15	;	;	PUNCT
ecletica-1352	229	16	odey	odey	PROPN
ecletica-1352	229	17	,	,	PUNCT
ecletica-1352	229	18	j.	j.	PROPN
ecletica-1352	229	19	o.	o.	PROPN
ecletica-1352	229	20	;	;	PUNCT
ecletica-1352	229	21	ubana	ubana	PROPN
ecletica-1352	229	22	,	,	PUNCT
ecletica-1352	229	23	e.	e.	PROPN
ecletica-1352	229	24	i.	i.	PROPN
ecletica-1352	229	25	;	;	PUNCT
ecletica-1352	229	26	edim	edim	PROPN
ecletica-1352	229	27	,	,	PUNCT
ecletica-1352	229	28	m.	m.	NOUN
ecletica-1352	229	29	m.	m.	NOUN
ecletica-1352	229	30	;	;	PUNCT
ecletica-1352	229	31	edim	edim	PROPN
ecletica-1352	229	32	,	,	PUNCT
ecletica-1352	229	33	m.	m.	NOUN
ecletica-1352	229	34	m.	m.	NOUN
ecletica-1352	229	35	;	;	PUNCT
ecletica-1352	229	36	tizhe	tizhe	PROPN
ecletica-1352	229	37	,	,	PUNCT
ecletica-1352	229	38	f.	f.	PROPN
ecletica-1352	229	39	t.	t.	PROPN
ecletica-1352	229	40	;	;	PUNCT
ecletica-1352	229	41	agwupuye	agwupuye	PROPN
ecletica-1352	229	42	,	,	PUNCT
ecletica-1352	229	43	j.	j.	PROPN
ecletica-1352	229	44	a.	a.	PROPN
ecletica-1352	229	45	;	;	PUNCT
ecletica-1352	229	46	utsu	utsu	NOUN
ecletica-1352	229	47	,	,	PUNCT
ecletica-1352	229	48	p.	p.	NOUN
ecletica-1352	229	49	m.	m.	NOUN
ecletica-1352	229	50	vibrational	vibrational	PROPN
ecletica-1352	229	51	,	,	PUNCT
ecletica-1352	229	52	electronic	electronic	ADJ
ecletica-1352	229	53	,	,	PUNCT
ecletica-1352	229	54	spectroscopic	spectroscopic	ADJ
ecletica-1352	229	55	properties	property	NOUN
ecletica-1352	229	56	,	,	PUNCT
ecletica-1352	229	57	and	and	CCONJ
ecletica-1352	229	58	nbo	nbo	VERB
ecletica-1352	229	59	analysis	analysis	NOUN
ecletica-1352	229	60	of	of	ADP
ecletica-1352	229	61	p	p	NOUN
ecletica-1352	229	62	-	-	PUNCT
ecletica-1352	229	63	xylene	xylene	NOUN
ecletica-1352	229	64	,	,	PUNCT
ecletica-1352	229	65	3	3	NUM
ecletica-1352	229	66	,	,	PUNCT
ecletica-1352	229	67	6	6	NUM
ecletica-1352	229	68	-	-	PUNCT
ecletica-1352	229	69	difluoro	difluoro	NOUN
ecletica-1352	229	70	-	-	PUNCT
ecletica-1352	229	71	pxylene	pxylene	NOUN
ecletica-1352	229	72	,	,	PUNCT
ecletica-1352	229	73	3	3	NUM
ecletica-1352	229	74	,	,	PUNCT
ecletica-1352	229	75	6	6	NUM
ecletica-1352	229	76	-	-	PUNCT
ecletica-1352	229	77	dichloro	dichloro	NOUN
ecletica-1352	229	78	-	-	PUNCT
ecletica-1352	229	79	p	p	NOUN
ecletica-1352	229	80	-	-	PUNCT
ecletica-1352	229	81	xylene	xylene	NOUN
ecletica-1352	229	82	and	and	CCONJ
ecletica-1352	229	83	3	3	NUM
ecletica-1352	229	84	,	,	PUNCT
ecletica-1352	229	85	6	6	NUM
ecletica-1352	229	86	-	-	PUNCT
ecletica-1352	229	87	dibromo	dibromo	NOUN
ecletica-1352	229	88	-	-	PUNCT
ecletica-1352	229	89	pxylene	pxylene	NOUN
ecletica-1352	229	90	:	:	PUNCT
ecletica-1352	229	91	dft	dft	PROPN
ecletica-1352	229	92	study	study	PROPN
ecletica-1352	229	93	.	.	PUNCT
ecletica-1352	230	1	heliyon	heliyon	NOUN
ecletica-1352	230	2	.	.	PUNCT
ecletica-1352	231	1	2020	2020	NUM
ecletica-1352	231	2	,	,	PUNCT
ecletica-1352	231	3	6	6	NUM
ecletica-1352	231	4	(	(	PUNCT
ecletica-1352	231	5	12	12	NUM
ecletica-1352	231	6	)	)	PUNCT
ecletica-1352	231	7	,	,	PUNCT
ecletica-1352	231	8	e05783	e05783	PROPN
ecletica-1352	231	9	.	.	PROPN
ecletica-1352	231	10	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	PROPN
ecletica-1352	231	11	cai	cai	PROPN
ecletica-1352	231	12	,	,	PUNCT
ecletica-1352	231	13	m.	m.	NOUN
ecletica-1352	231	14	;	;	PUNCT
ecletica-1352	231	15	chen	chen	PROPN
ecletica-1352	231	16	,	,	PUNCT
ecletica-1352	231	17	g.	g.	PROPN
ecletica-1352	231	18	;	;	PUNCT
ecletica-1352	231	19	qin	qin	PROPN
ecletica-1352	231	20	,	,	PUNCT
ecletica-1352	231	21	l.	l.	PROPN
ecletica-1352	231	22	;	;	PUNCT
ecletica-1352	231	23	qu	qu	PROPN
ecletica-1352	231	24	,	,	PUNCT
ecletica-1352	231	25	c.	c.	PROPN
ecletica-1352	231	26	;	;	PUNCT
ecletica-1352	231	27	dong	dong	PROPN
ecletica-1352	231	28	,	,	PUNCT
ecletica-1352	231	29	x.	x.	PROPN
ecletica-1352	231	30	;	;	PUNCT
ecletica-1352	231	31	ni	ni	PROPN
ecletica-1352	231	32	,	,	PUNCT
ecletica-1352	231	33	j.	j.	PROPN
ecletica-1352	231	34	;	;	PUNCT
ecletica-1352	231	35	yin	yin	PROPN
ecletica-1352	231	36	,	,	PUNCT
ecletica-1352	231	37	x.	x.	NOUN
ecletica-1352	231	38	metal	metal	NOUN
ecletica-1352	231	39	organic	organic	ADJ
ecletica-1352	231	40	frameworks	framework	NOUN
ecletica-1352	231	41	as	as	ADP
ecletica-1352	231	42	drug	drug	NOUN
ecletica-1352	231	43	targeting	target	VERB
ecletica-1352	231	44	delivery	delivery	NOUN
ecletica-1352	231	45	vehicles	vehicle	NOUN
ecletica-1352	231	46	in	in	ADP
ecletica-1352	231	47	the	the	DET
ecletica-1352	231	48	treatment	treatment	NOUN
ecletica-1352	231	49	of	of	ADP
ecletica-1352	231	50	cancer	cancer	NOUN
ecletica-1352	231	51	.	.	PUNCT
ecletica-1352	232	1	pharmaceutics	pharmaceutic	NOUN
ecletica-1352	232	2	.	.	PUNCT
ecletica-1352	233	1	2020	2020	NUM
ecletica-1352	233	2	,	,	PUNCT
ecletica-1352	233	3	12	12	NUM
ecletica-1352	233	4	(	(	PUNCT
ecletica-1352	233	5	3	3	NUM
ecletica-1352	233	6	)	)	PUNCT
ecletica-1352	233	7	,	,	PUNCT
ecletica-1352	233	8	232	232	NUM
ecletica-1352	233	9	.	.	PUNCT
ecletica-1352	234	1	https://doi.org/10.3390/pharmaceutics12030232	https://doi.org/10.3390/pharmaceutics12030232	PROPN
ecletica-1352	234	2	chuhadiya	chuhadiya	PROPN
ecletica-1352	234	3	,	,	PUNCT
ecletica-1352	234	4	s.	s.	PROPN
ecletica-1352	234	5	;	;	PUNCT
ecletica-1352	234	6	suthar	suthar	PROPN
ecletica-1352	234	7	,	,	PUNCT
ecletica-1352	234	8	h.	h.	PROPN
ecletica-1352	234	9	d.	d.	PROPN
ecletica-1352	234	10	;	;	PUNCT
ecletica-1352	234	11	patel	patel	PROPN
ecletica-1352	234	12	,	,	PUNCT
ecletica-1352	234	13	s.	s.	PROPN
ecletica-1352	234	14	l.	l.	PROPN
ecletica-1352	234	15	;	;	PUNCT
ecletica-1352	234	16	dhaka	dhaka	PROPN
ecletica-1352	234	17	,	,	PUNCT
ecletica-1352	234	18	m.	m.	NOUN
ecletica-1352	234	19	s.	s.	PROPN
ecletica-1352	234	20	metal	metal	PROPN
ecletica-1352	234	21	organic	organic	ADJ
ecletica-1352	234	22	frameworks	framework	NOUN
ecletica-1352	234	23	as	as	ADP
ecletica-1352	234	24	hybrid	hybrid	ADJ
ecletica-1352	234	25	porous	porous	ADJ
ecletica-1352	234	26	materials	material	NOUN
ecletica-1352	234	27	for	for	ADP
ecletica-1352	234	28	energy	energy	NOUN
ecletica-1352	234	29	storage	storage	NOUN
ecletica-1352	234	30	and	and	CCONJ
ecletica-1352	234	31	conversion	conversion	NOUN
ecletica-1352	234	32	devices	device	NOUN
ecletica-1352	234	33	:	:	PUNCT
ecletica-1352	234	34	a	a	DET
ecletica-1352	234	35	review	review	NOUN
ecletica-1352	234	36	.	.	PUNCT
ecletica-1352	235	1	coord	coord	NOUN
ecletica-1352	235	2	.	.	PUNCT
ecletica-1352	236	1	chem	chem	PROPN
ecletica-1352	236	2	.	.	PUNCT
ecletica-1352	237	1	rev	rev	PROPN
ecletica-1352	237	2	.	.	PROPN
ecletica-1352	237	3	2021	2021	NUM
ecletica-1352	237	4	,	,	PUNCT
ecletica-1352	237	5	446	446	NUM
ecletica-1352	237	6	,	,	PUNCT
ecletica-1352	237	7	214115	214115	NUM
ecletica-1352	237	8	.	.	PUNCT
ecletica-1352	238	1	https://doi.org/10.1016/j.ccr.2021.214115	https://doi.org/10.1016/j.ccr.2021.214115	PROPN
ecletica-1352	238	2	daina	daina	PROPN
ecletica-1352	238	3	,	,	PUNCT
ecletica-1352	238	4	a.	a.	PROPN
ecletica-1352	238	5	;	;	PUNCT
ecletica-1352	238	6	michielin	michielin	PROPN
ecletica-1352	238	7	,	,	PUNCT
ecletica-1352	238	8	o.	o.	PROPN
ecletica-1352	238	9	;	;	PUNCT
ecletica-1352	238	10	zoete	zoete	NOUN
ecletica-1352	238	11	,	,	PUNCT
ecletica-1352	238	12	v.	v.	ADP
ecletica-1352	238	13	swissadme	swissadme	PROPN
ecletica-1352	238	14	:	:	PUNCT
ecletica-1352	238	15	a	a	DET
ecletica-1352	238	16	free	free	ADJ
ecletica-1352	238	17	web	web	NOUN
ecletica-1352	238	18	tool	tool	NOUN
ecletica-1352	238	19	to	to	PART
ecletica-1352	238	20	evaluate	evaluate	VERB
ecletica-1352	238	21	pharmacokinetics	pharmacokinetic	NOUN
ecletica-1352	238	22	,	,	PUNCT
ecletica-1352	238	23	drug	drug	NOUN
ecletica-1352	238	24	-	-	PUNCT
ecletica-1352	238	25	likeness	likeness	NOUN
ecletica-1352	238	26	and	and	CCONJ
ecletica-1352	238	27	medicinal	medicinal	ADJ
ecletica-1352	238	28	chemistry	chemistry	NOUN
ecletica-1352	238	29	friendliness	friendliness	NOUN
ecletica-1352	238	30	of	of	ADP
ecletica-1352	238	31	small	small	ADJ
ecletica-1352	238	32	molecules	molecule	NOUN
ecletica-1352	238	33	.	.	PUNCT
ecletica-1352	239	1	sci	sci	PROPN
ecletica-1352	239	2	.	.	PROPN
ecletica-1352	239	3	rep	rep	PROPN
ecletica-1352	239	4	.	.	PROPN
ecletica-1352	239	5	2017	2017	NUM
ecletica-1352	239	6	,	,	PUNCT
ecletica-1352	239	7	7	7	NUM
ecletica-1352	239	8	(	(	PUNCT
ecletica-1352	239	9	1	1	NUM
ecletica-1352	239	10	)	)	PUNCT
ecletica-1352	239	11	,	,	PUNCT
ecletica-1352	239	12	42717	42717	NUM
ecletica-1352	239	13	.	.	PUNCT
ecletica-1352	240	1	https://doi.org/10.1038/srep42717	https://doi.org/10.1038/srep42717	PROPN
ecletica-1352	240	2	dennington	dennington	PROPN
ecletica-1352	240	3	,	,	PUNCT
ecletica-1352	240	4	r.	r.	PROPN
ecletica-1352	240	5	;	;	PUNCT
ecletica-1352	240	6	keith	keith	PROPN
ecletica-1352	240	7	,	,	PUNCT
ecletica-1352	240	8	t.	t.	PROPN
ecletica-1352	240	9	a.	a.	NOUN
ecletica-1352	240	10	;	;	PUNCT
ecletica-1352	240	11	millam	millam	PROPN
ecletica-1352	240	12	,	,	PUNCT
ecletica-1352	240	13	j.	j.	PROPN
ecletica-1352	240	14	m.	m.	PROPN
ecletica-1352	240	15	(	(	PUNCT
ecletica-1352	240	16	2016	2016	NUM
ecletica-1352	240	17	)	)	PUNCT
ecletica-1352	240	18	.	.	PUNCT
ecletica-1352	241	1	gauss	gauss	ADJ
ecletica-1352	241	2	view	view	NOUN
ecletica-1352	241	3	6.0	6.0	NUM
ecletica-1352	241	4	.	.	PUNCT
ecletica-1352	242	1	16	16	NUM
ecletica-1352	242	2	.	.	PUNCT
ecletica-1352	242	3	semichem	semichem	PROPN
ecletica-1352	242	4	inc	inc	PROPN
ecletica-1352	242	5	.	.	PROPN
ecletica-1352	242	6	:	:	PUNCT
ecletica-1352	242	7	missão	missão	PROPN
ecletica-1352	242	8	shawnee	shawnee	PROPN
ecletica-1352	242	9	,	,	PUNCT
ecletica-1352	242	10	ks	ks	PROPN
ecletica-1352	242	11	,	,	PUNCT
ecletica-1352	242	12	eua	eua	PROPN
ecletica-1352	242	13	.	.	PUNCT
ecletica-1352	243	1	hyperchem	hyperchem	PROPN
ecletica-1352	243	2	,	,	PUNCT
ecletica-1352	243	3	t.	t.	PROPN
ecletica-1352	243	4	hyperchem	hyperchem	PROPN
ecletica-1352	243	5	8.07	8.07	NUM
ecletica-1352	243	6	,	,	PUNCT
ecletica-1352	243	7	programa	programa	NOUN
ecletica-1352	243	8	profissional	profissional	PROPN
ecletica-1352	243	9	hyperchem	hyperchem	NOUN
ecletica-1352	243	10	.	.	PUNCT
ecletica-1352	244	1	gainesville	gainesville	PROPN
ecletica-1352	244	2	,	,	PUNCT
ecletica-1352	244	3	hipercubo	hipercubo	PROPN
ecletica-1352	244	4	.	.	PUNCT
ecletica-1352	245	1	2001	2001	NUM
ecletica-1352	245	2	.	.	PUNCT
ecletica-1352	246	1	deshpande	deshpande	PROPN
ecletica-1352	246	2	,	,	PUNCT
ecletica-1352	246	3	n.	n.	NOUN
ecletica-1352	246	4	;	;	PUNCT
ecletica-1352	246	5	addess	addess	PROPN
ecletica-1352	246	6	,	,	PUNCT
ecletica-1352	246	7	k.	k.	PROPN
ecletica-1352	246	8	j.	j.	PROPN
ecletica-1352	246	9	;	;	PUNCT
ecletica-1352	246	10	bluhm	bluhm	PROPN
ecletica-1352	246	11	,	,	PUNCT
ecletica-1352	246	12	w.	w.	PROPN
ecletica-1352	246	13	f.	f.	PROPN
ecletica-1352	246	14	;	;	PUNCT
ecletica-1352	246	15	merino	merino	PROPN
ecletica-1352	246	16	-	-	PUNCT
ecletica-1352	246	17	ott	ott	PROPN
ecletica-1352	246	18	,	,	PUNCT
ecletica-1352	246	19	j.	j.	PROPN
ecletica-1352	246	20	c.	c.	PROPN
ecletica-1352	246	21	;	;	PUNCT
ecletica-1352	246	22	townsend	townsend	PROPN
ecletica-1352	246	23	-	-	PUNCT
ecletica-1352	246	24	merino	merino	PROPN
ecletica-1352	246	25	,	,	PUNCT
ecletica-1352	246	26	w.	w.	PROPN
ecletica-1352	246	27	;	;	PUNCT
ecletica-1352	246	28	zhang	zhang	PROPN
ecletica-1352	246	29	,	,	PUNCT
ecletica-1352	246	30	q.	q.	PROPN
ecletica-1352	246	31	;	;	PUNCT
ecletica-1352	246	32	knezevich	knezevich	PROPN
ecletica-1352	246	33	,	,	PUNCT
ecletica-1352	246	34	c.	c.	PROPN
ecletica-1352	246	35	;	;	PUNCT
ecletica-1352	246	36	xie	xie	PROPN
ecletica-1352	246	37	,	,	PUNCT
ecletica-1352	246	38	l.	l.	PROPN
ecletica-1352	246	39	;	;	PUNCT
ecletica-1352	246	40	chen	chen	PROPN
ecletica-1352	246	41	,	,	PUNCT
ecletica-1352	246	42	l.	l.	PROPN
ecletica-1352	246	43	;	;	PUNCT
ecletica-1352	246	44	feng	feng	PROPN
ecletica-1352	246	45	,	,	PUNCT
ecletica-1352	246	46	z.	z.	PROPN
ecletica-1352	246	47	;	;	PUNCT
ecletica-1352	246	48	green	green	PROPN
ecletica-1352	246	49	,	,	PUNCT
ecletica-1352	246	50	r.	r.	PROPN
ecletica-1352	246	51	k.	k.	PROPN
ecletica-1352	246	52	;	;	PUNCT
ecletica-1352	246	53	flippen	flippen	PROPN
ecletica-1352	246	54	-	-	PUNCT
ecletica-1352	246	55	anderson	anderson	PROPN
ecletica-1352	246	56	,	,	PUNCT
ecletica-1352	246	57	j.	j.	PROPN
ecletica-1352	246	58	l.	l.	PROPN
ecletica-1352	246	59	;	;	PUNCT
ecletica-1352	246	60	westbrook	westbrook	PROPN
ecletica-1352	246	61	,	,	PUNCT
ecletica-1352	246	62	j.	j.	PROPN
ecletica-1352	246	63	;	;	PUNCT
ecletica-1352	246	64	berman	berman	PROPN
ecletica-1352	246	65	,	,	PUNCT
ecletica-1352	246	66	h.	h.	PROPN
ecletica-1352	246	67	m.	m.	NOUN
ecletica-1352	246	68	;	;	PUNCT
ecletica-1352	246	69	bourne	bourne	NOUN
ecletica-1352	246	70	,	,	PUNCT
ecletica-1352	246	71	p.	p.	NOUN
ecletica-1352	246	72	e.	e.	PROPN
ecletica-1352	247	1	the	the	DET
ecletica-1352	247	2	rcsb	rcsb	ADJ
ecletica-1352	247	3	protein	protein	NOUN
ecletica-1352	247	4	data	datum	NOUN
ecletica-1352	247	5	bank	bank	NOUN
ecletica-1352	247	6	:	:	PUNCT
ecletica-1352	247	7	a	a	DET
ecletica-1352	247	8	redesigned	redesign	VERB
ecletica-1352	247	9	query	query	NOUN
ecletica-1352	247	10	system	system	NOUN
ecletica-1352	247	11	and	and	CCONJ
ecletica-1352	247	12	relational	relational	ADJ
ecletica-1352	247	13	database	database	NOUN
ecletica-1352	247	14	based	base	VERB
ecletica-1352	247	15	on	on	ADP
ecletica-1352	247	16	the	the	DET
ecletica-1352	247	17	mmcif	mmcif	ADJ
ecletica-1352	247	18	schema	schema	NOUN
ecletica-1352	247	19	.	.	PUNCT
ecletica-1352	248	1	nucleic	nucleic	ADJ
ecletica-1352	248	2	acids	acid	NOUN
ecletica-1352	248	3	res	re	NOUN
ecletica-1352	248	4	.	.	PUNCT
ecletica-1352	248	5	2005	2005	NUM
ecletica-1352	248	6	,	,	PUNCT
ecletica-1352	248	7	33	33	NUM
ecletica-1352	248	8	(	(	PUNCT
ecletica-1352	248	9	suppl	suppl	NOUN
ecletica-1352	248	10	1	1	NUM
ecletica-1352	248	11	)	)	PUNCT
ecletica-1352	248	12	,	,	PUNCT
ecletica-1352	248	13	d233	d233	PROPN
ecletica-1352	248	14	–	–	PUNCT
ecletica-1352	248	15	d237	d237	PROPN
ecletica-1352	248	16	.	.	PUNCT
ecletica-1352	249	1	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	249	2	el	el	PROPN
ecletica-1352	249	3	-	-	PUNCT
ecletica-1352	249	4	gammal	gammal	NOUN
ecletica-1352	249	5	,	,	PUNCT
ecletica-1352	249	6	o.	o.	PROPN
ecletica-1352	249	7	a.	a.	PROPN
ecletica-1352	249	8	;	;	PUNCT
ecletica-1352	249	9	rakha	rakha	PROPN
ecletica-1352	249	10	,	,	PUNCT
ecletica-1352	249	11	t.	t.	PROPN
ecletica-1352	249	12	h.	h.	PROPN
ecletica-1352	249	13	;	;	PUNCT
ecletica-1352	249	14	metwally	metwally	ADV
ecletica-1352	249	15	,	,	PUNCT
ecletica-1352	249	16	h.	h.	PROPN
ecletica-1352	249	17	m.	m.	PROPN
ecletica-1352	249	18	;	;	PUNCT
ecletica-1352	249	19	el	el	PROPN
ecletica-1352	249	20	-	-	PUNCT
ecletica-1352	249	21	reash	reash	PROPN
ecletica-1352	249	22	,	,	PUNCT
ecletica-1352	249	23	g.	g.	PROPN
ecletica-1352	249	24	m.	m.	PROPN
ecletica-1352	249	25	a.	a.	NOUN
ecletica-1352	249	26	synthesis	synthesis	PROPN
ecletica-1352	249	27	,	,	PUNCT
ecletica-1352	249	28	characterization	characterization	NOUN
ecletica-1352	249	29	,	,	PUNCT
ecletica-1352	249	30	dft	dft	PROPN
ecletica-1352	249	31	and	and	CCONJ
ecletica-1352	249	32	biological	biological	ADJ
ecletica-1352	249	33	studies	study	NOUN
ecletica-1352	249	34	of	of	ADP
ecletica-1352	249	35	isatinpicolinohydrazone	isatinpicolinohydrazone	NOUN
ecletica-1352	249	36	and	and	CCONJ
ecletica-1352	249	37	its	its	PRON
ecletica-1352	249	38	zn	zn	PROPN
ecletica-1352	249	39	(	(	PUNCT
ecletica-1352	249	40	ii	ii	PROPN
ecletica-1352	249	41	)	)	PUNCT
ecletica-1352	249	42	,	,	PUNCT
ecletica-1352	249	43	cd	cd	PROPN
ecletica-1352	249	44	(	(	PUNCT
ecletica-1352	249	45	ii	ii	PROPN
ecletica-1352	249	46	)	)	PUNCT
ecletica-1352	249	47	and	and	CCONJ
ecletica-1352	249	48	hg	hg	PROPN
ecletica-1352	249	49	(	(	PUNCT
ecletica-1352	249	50	ii	ii	NOUN
ecletica-1352	249	51	)	)	PUNCT
ecletica-1352	249	52	complexes	complex	NOUN
ecletica-1352	249	53	.	.	PUNCT
ecletica-1352	250	1	spectrochim	spectrochim	PROPN
ecletica-1352	250	2	.	.	PUNCT
ecletica-1352	251	1	acta	acta	PROPN
ecletica-1352	251	2	a	a	DET
ecletica-1352	251	3	mol	mol	PROPN
ecletica-1352	251	4	.	.	PROPN
ecletica-1352	251	5	biomol	biomol	PROPN
ecletica-1352	251	6	.	.	PUNCT
ecletica-1352	252	1	spectrosc	spectrosc	PROPN
ecletica-1352	252	2	.	.	PUNCT
ecletica-1352	253	1	2014	2014	NUM
ecletica-1352	253	2	,	,	PUNCT
ecletica-1352	253	3	127	127	NUM
ecletica-1352	253	4	,	,	PUNCT
ecletica-1352	253	5	144–156	144–156	NUM
ecletica-1352	253	6	.	.	PUNCT
ecletica-1352	254	1	https://doi.org/10.1016/j.saa.2014.02.008	https://doi.org/10.1016/j.saa.2014.02.008	PROPN
ecletica-1352	254	2	emori	emori	PROPN
ecletica-1352	254	3	,	,	PUNCT
ecletica-1352	254	4	w.	w.	PROPN
ecletica-1352	254	5	;	;	PUNCT
ecletica-1352	254	6	louis	louis	PROPN
ecletica-1352	254	7	,	,	PUNCT
ecletica-1352	254	8	h.	h.	PROPN
ecletica-1352	254	9	;	;	PUNCT
ecletica-1352	254	10	adalikwu	adalikwu	PROPN
ecletica-1352	254	11	,	,	PUNCT
ecletica-1352	254	12	s.	s.	PROPN
ecletica-1352	254	13	a.	a.	PROPN
ecletica-1352	254	14	;	;	PUNCT
ecletica-1352	254	15	timothy	timothy	PROPN
ecletica-1352	254	16	,	,	PUNCT
ecletica-1352	254	17	r.	r.	PROPN
ecletica-1352	254	18	a.	a.	PROPN
ecletica-1352	254	19	;	;	PUNCT
ecletica-1352	255	1	cheng	cheng	PROPN
ecletica-1352	255	2	,	,	PUNCT
ecletica-1352	255	3	c.-r	c.-r	PROPN
ecletica-1352	255	4	.	.	PUNCT
ecletica-1352	255	5	;	;	PUNCT
ecletica-1352	255	6	gber	gber	PROPN
ecletica-1352	255	7	,	,	PUNCT
ecletica-1352	255	8	t.	t.	PROPN
ecletica-1352	255	9	e.	e.	PROPN
ecletica-1352	255	10	;	;	PUNCT
ecletica-1352	255	11	agwamba	agwamba	PROPN
ecletica-1352	255	12	,	,	PUNCT
ecletica-1352	255	13	e.	e.	PROPN
ecletica-1352	255	14	c.	c.	PROPN
ecletica-1352	255	15	;	;	PUNCT
ecletica-1352	255	16	owen	owen	PROPN
ecletica-1352	255	17	,	,	PUNCT
ecletica-1352	255	18	a.	a.	PROPN
ecletica-1352	255	19	e.	e.	PROPN
ecletica-1352	255	20	;	;	PUNCT
ecletica-1352	255	21	ling	ling	PROPN
ecletica-1352	255	22	,	,	PUNCT
ecletica-1352	255	23	l.	l.	PROPN
ecletica-1352	255	24	;	;	PUNCT
ecletica-1352	255	25	offiong	offiong	PROPN
ecletica-1352	255	26	,	,	PUNCT
ecletica-1352	255	27	o.	o.	PROPN
ecletica-1352	255	28	e.	e.	PROPN
ecletica-1352	255	29	;	;	PUNCT
ecletica-1352	255	30	adeyinka	adeyinka	PROPN
ecletica-1352	255	31	,	,	PUNCT
ecletica-1352	255	32	a.	a.	NOUN
ecletica-1352	255	33	s.	s.	PROPN
ecletica-1352	256	1	molecular	molecular	ADJ
ecletica-1352	256	2	modeling	modeling	NOUN
ecletica-1352	256	3	of	of	ADP
ecletica-1352	256	4	the	the	DET
ecletica-1352	256	5	spectroscopic	spectroscopic	NOUN
ecletica-1352	256	6	,	,	PUNCT
ecletica-1352	256	7	structural	structural	ADJ
ecletica-1352	256	8	,	,	PUNCT
ecletica-1352	256	9	and	and	CCONJ
ecletica-1352	256	10	bioactive	bioactive	VERB
ecletica-1352	256	11	potential	potential	NOUN
ecletica-1352	256	12	of	of	ADP
ecletica-1352	256	13	tetrahydropalmatine	tetrahydropalmatine	NOUN
ecletica-1352	256	14	:	:	PUNCT
ecletica-1352	256	15	insight	insight	NOUN
ecletica-1352	256	16	from	from	ADP
ecletica-1352	256	17	experimental	experimental	ADJ
ecletica-1352	256	18	and	and	CCONJ
ecletica-1352	256	19	theoretical	theoretical	ADJ
ecletica-1352	256	20	approach	approach	NOUN
ecletica-1352	256	21	.	.	PUNCT
ecletica-1352	257	1	polycycl	polycycl	PROPN
ecletica-1352	257	2	.	.	PUNCT
ecletica-1352	257	3	aromat	aromat	PROPN
ecletica-1352	257	4	.	.	PUNCT
ecletica-1352	258	1	compd	compd	PROPN
ecletica-1352	258	2	.	.	PUNCT
ecletica-1352	259	1	2022	2022	NUM
ecletica-1352	259	2	,	,	PUNCT
ecletica-1352	259	3	1–18	1–18	NUM
ecletica-1352	259	4	.	.	PUNCT
ecletica-1352	260	1	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	PROPN
ecletica-1352	260	2	eno	eno	PROPN
ecletica-1352	260	3	,	,	PUNCT
ecletica-1352	260	4	e.	e.	PROPN
ecletica-1352	260	5	a.	a.	PROPN
ecletica-1352	260	6	;	;	PUNCT
ecletica-1352	260	7	louis	louis	PROPN
ecletica-1352	260	8	,	,	PUNCT
ecletica-1352	260	9	h.	h.	PROPN
ecletica-1352	260	10	;	;	PUNCT
ecletica-1352	260	11	unimuke	unimuke	NOUN
ecletica-1352	260	12	,	,	PUNCT
ecletica-1352	260	13	t.	t.	PROPN
ecletica-1352	260	14	o.	o.	PROPN
ecletica-1352	260	15	;	;	PUNCT
ecletica-1352	260	16	gber	gber	PROPN
ecletica-1352	260	17	,	,	PUNCT
ecletica-1352	260	18	t.	t.	PROPN
ecletica-1352	260	19	e.	e.	PROPN
ecletica-1352	260	20	;	;	PUNCT
ecletica-1352	260	21	mbonu	mbonu	PROPN
ecletica-1352	260	22	,	,	PUNCT
ecletica-1352	260	23	i.	i.	PROPN
ecletica-1352	260	24	j.	j.	PROPN
ecletica-1352	260	25	;	;	PUNCT
ecletica-1352	260	26	ndubisi	ndubisi	PROPN
ecletica-1352	260	27	,	,	PUNCT
ecletica-1352	260	28	c.	c.	PROPN
ecletica-1352	260	29	j.	j.	PROPN
ecletica-1352	260	30	;	;	PUNCT
ecletica-1352	260	31	adalikwu	adalikwu	PROPN
ecletica-1352	260	32	,	,	PUNCT
ecletica-1352	260	33	s.	s.	PROPN
ecletica-1352	260	34	a.	a.	NOUN
ecletica-1352	260	35	reactivity	reactivity	NOUN
ecletica-1352	260	36	,	,	PUNCT
ecletica-1352	260	37	stability	stability	NOUN
ecletica-1352	260	38	,	,	PUNCT
ecletica-1352	260	39	and	and	CCONJ
ecletica-1352	260	40	thermodynamics	thermodynamic	NOUN
ecletica-1352	260	41	of	of	ADP
ecletica-1352	260	42	para	para	ADJ
ecletica-1352	260	43	-	-	PUNCT
ecletica-1352	260	44	methylpyridinium	methylpyridinium	NOUN
ecletica-1352	260	45	-	-	PUNCT
ecletica-1352	260	46	based	base	VERB
ecletica-1352	260	47	ionic	ionic	ADJ
ecletica-1352	260	48	liquids	liquid	NOUN
ecletica-1352	260	49	:	:	PUNCT
ecletica-1352	260	50	insight	insight	NOUN
ecletica-1352	260	51	from	from	ADP
ecletica-1352	260	52	dft	dft	PROPN
ecletica-1352	260	53	,	,	PUNCT
ecletica-1352	260	54	nci	nci	PROPN
ecletica-1352	260	55	,	,	PUNCT
ecletica-1352	260	56	and	and	CCONJ
ecletica-1352	260	57	qtaim	qtaim	NOUN
ecletica-1352	260	58	.	.	PUNCT
ecletica-1352	261	1	journal	journal	PROPN
ecletica-1352	261	2	of	of	ADP
ecletica-1352	261	3	ionic	ionic	ADJ
ecletica-1352	261	4	liquids	liquid	NOUN
ecletica-1352	261	5	.	.	PUNCT
ecletica-1352	262	1	2022	2022	NUM
ecletica-1352	262	2	,	,	PUNCT
ecletica-1352	262	3	2	2	NUM
ecletica-1352	262	4	(	(	PUNCT
ecletica-1352	262	5	1	1	NUM
ecletica-1352	262	6	)	)	PUNCT
ecletica-1352	262	7	,	,	PUNCT
ecletica-1352	262	8	100030	100030	NUM
ecletica-1352	262	9	.	.	PUNCT
ecletica-1352	263	1	https://doi.org/10.1016/j.jil.2022.100030	https://doi.org/10.1016/j.jil.2022.100030	PROPN
ecletica-1352	263	2	frisch	frisch	VERB
ecletica-1352	263	3	,	,	PUNCT
ecletica-1352	263	4	m.	m.	NOUN
ecletica-1352	263	5	j.	j.	PROPN
ecletica-1352	263	6	;	;	PUNCT
ecletica-1352	263	7	trucks	truck	NOUN
ecletica-1352	263	8	.	.	PUNCT
ecletica-1352	264	1	g.	g.	PROPN
ecletica-1352	264	2	w.	w.	PROPN
ecletica-1352	264	3	;	;	PUNCT
ecletica-1352	264	4	schlegel	schlegel	PROPN
ecletica-1352	264	5	,	,	PUNCT
ecletica-1352	264	6	h.	h.	PROPN
ecletica-1352	264	7	b.	b.	PROPN
ecletica-1352	264	8	;	;	PUNCT
ecletica-1352	264	9	scuseria	scuseria	PROPN
ecletica-1352	264	10	,	,	PUNCT
ecletica-1352	264	11	g.	g.	PROPN
ecletica-1352	264	12	e.	e.	PROPN
ecletica-1352	264	13	;	;	PUNCT
ecletica-1352	264	14	robb	robb	NOUN
ecletica-1352	264	15	,	,	PUNCT
ecletica-1352	264	16	m.	m.	NOUN
ecletica-1352	264	17	a.	a.	PROPN
ecletica-1352	264	18	;	;	PUNCT
ecletica-1352	264	19	cheeseman	cheeseman	PROPN
ecletica-1352	264	20	,	,	PUNCT
ecletica-1352	264	21	j.	j.	PROPN
ecletica-1352	264	22	r.	r.	PROPN
ecletica-1352	264	23	;	;	PUNCT
ecletica-1352	264	24	scalmani	scalmani	PROPN
ecletica-1352	264	25	,	,	PUNCT
ecletica-1352	264	26	g.	g.	PROPN
ecletica-1352	264	27	;	;	PUNCT
ecletica-1352	264	28	barone	barone	PROPN
ecletica-1352	264	29	,	,	PUNCT
ecletica-1352	264	30	v.	v.	PROPN
ecletica-1352	264	31	;	;	PUNCT
ecletica-1352	264	32	petersson	petersson	NOUN
ecletica-1352	264	33	,	,	PUNCT
ecletica-1352	264	34	g.	g.	PROPN
ecletica-1352	264	35	a.	a.	PROPN
ecletica-1352	264	36	;	;	PUNCT
ecletica-1352	264	37	nakatsuji	nakatsuji	PROPN
ecletica-1352	264	38	,	,	PUNCT
ecletica-1352	264	39	h.	h.	PROPN
ecletica-1352	264	40	x.	x.	PROPN
ecletica-1352	264	41	;	;	PUNCT
ecletica-1352	264	42	caricato	caricato	PROPN
ecletica-1352	264	43	,	,	PUNCT
ecletica-1352	264	44	li	li	PROPN
ecletica-1352	264	45	.	.	PROPN
ecletica-1352	264	46	m.	m.	NOUN
ecletica-1352	264	47	;	;	PUNCT
ecletica-1352	264	48	marenich	marenich	PROPN
ecletica-1352	264	49	,	,	PUNCT
ecletica-1352	264	50	a.	a.	PROPN
ecletica-1352	264	51	v.	v.	PROPN
ecletica-1352	264	52	;	;	PUNCT
ecletica-1352	264	53	bloino	bloino	NOUN
ecletica-1352	264	54	,	,	PUNCT
ecletica-1352	264	55	j.	j.	PROPN
ecletica-1352	264	56	;	;	PUNCT
ecletica-1352	264	57	janesko	janesko	ADV
ecletica-1352	264	58	.	.	PUNCT
ecletica-1352	264	59	;	;	PUNCT
ecletica-1352	264	60	b.	b.	PROPN
ecletica-1352	264	61	g.	g.	PROPN
ecletica-1352	264	62	;	;	PUNCT
ecletica-1352	264	63	gomperts	gomperts	PROPN
ecletica-1352	264	64	,	,	PUNCT
ecletica-1352	264	65	r.	r.	PROPN
ecletica-1352	264	66	;	;	PUNCT
ecletica-1352	264	67	mennucci	mennucci	PROPN
ecletica-1352	264	68	,	,	PUNCT
ecletica-1352	264	69	b.	b.	PROPN
ecletica-1352	264	70	;	;	PUNCT
ecletica-1352	264	71	hratchian	hratchian	PROPN
ecletica-1352	264	72	,	,	PUNCT
ecletica-1352	264	73	h.	h.	PROPN
ecletica-1352	264	74	p.	p.	PROPN
ecletica-1352	264	75	;	;	PUNCT
ecletica-1352	264	76	ortiz	ortiz	PROPN
ecletica-1352	264	77	,	,	PUNCT
ecletica-1352	264	78	j.	j.	PROPN
ecletica-1352	264	79	v.	v.	PROPN
ecletica-1352	264	80	;	;	PUNCT
ecletica-1352	264	81	izmaylov	izmaylov	ADJ
ecletica-1352	264	82	,	,	PUNCT
ecletica-1352	264	83	a.	a.	PROPN
ecletica-1352	264	84	f.	f.	PROPN
ecletica-1352	264	85	;	;	PUNCT
ecletica-1352	264	86	sonnenberg	sonnenberg	PROPN
ecletica-1352	264	87	,	,	PUNCT
ecletica-1352	264	88	j.	j.	PROPN
ecletica-1352	264	89	l.	l.	PROPN
ecletica-1352	264	90	;	;	PUNCT
ecletica-1352	264	91	williams	williams	PROPN
ecletica-1352	264	92	-	-	PUNCT
ecletica-1352	264	93	yong	yong	PROPN
ecletica-1352	264	94	,	,	PUNCT
ecletica-1352	264	95	d.	d.	PROPN
ecletica-1352	264	96	;	;	PUNCT
ecletica-1352	264	97	ding	ding	PROPN
ecletica-1352	264	98	,	,	PUNCT
ecletica-1352	264	99	f.	f.	PROPN
ecletica-1352	264	100	;	;	PUNCT
ecletica-1352	264	101	lipparini	lipparini	PROPN
ecletica-1352	264	102	,	,	PUNCT
ecletica-1352	264	103	f.	f.	PROPN
ecletica-1352	264	104	egidi	egidi	PROPN
ecletica-1352	264	105	,	,	PUNCT
ecletica-1352	264	106	f.	f.	PROPN
ecletica-1352	264	107	;	;	PUNCT
ecletica-1352	264	108	goings	going	NOUN
ecletica-1352	264	109	,	,	PUNCT
ecletica-1352	264	110	j.	j.	PROPN
ecletica-1352	264	111	;	;	PUNCT
ecletica-1352	264	112	peng	peng	PROPN
ecletica-1352	264	113	,	,	PUNCT
ecletica-1352	264	114	b.	b.	PROPN
ecletica-1352	264	115	;	;	PUNCT
ecletica-1352	264	116	petrone	petrone	NOUN
ecletica-1352	264	117	,	,	PUNCT
ecletica-1352	264	118	a.	a.	NOUN
ecletica-1352	264	119	;	;	PUNCT
ecletica-1352	264	120	henderson	henderson	PROPN
ecletica-1352	264	121	,	,	PUNCT
ecletica-1352	264	122	t.	t.	PROPN
ecletica-1352	264	123	;	;	PUNCT
ecletica-1352	264	124	ranasinghe	ranasinghe	NOUN
ecletica-1352	264	125	,	,	PUNCT
ecletica-1352	264	126	d.	d.	PROPN
ecletica-1352	264	127	;	;	PUNCT
ecletica-1352	264	128	zakrzewski	zakrzewski	PROPN
ecletica-1352	264	129	,	,	PUNCT
ecletica-1352	264	130	v.	v.	PROPN
ecletica-1352	264	131	g.	g.	PROPN
ecletica-1352	264	132	;	;	PUNCT
ecletica-1352	264	133	gao	gao	PROPN
ecletica-1352	264	134	,	,	PUNCT
ecletica-1352	264	135	j.	j.	PROPN
ecletica-1352	264	136	;	;	PUNCT
ecletica-1352	264	137	rega	rega	PROPN
ecletica-1352	264	138	,	,	PUNCT
ecletica-1352	264	139	n.	n.	PROPN
ecletica-1352	264	140	;	;	PUNCT
ecletica-1352	264	141	zheng	zheng	PROPN
ecletica-1352	264	142	,	,	PUNCT
ecletica-1352	264	143	g.	g.	PROPN
ecletica-1352	264	144	;	;	PUNCT
ecletica-1352	264	145	liang	liang	PROPN
ecletica-1352	264	146	,	,	PUNCT
ecletica-1352	264	147	w.	w.	PROPN
ecletica-1352	264	148	;	;	PUNCT
ecletica-1352	264	149	hada	hada	PROPN
ecletica-1352	264	150	,	,	PUNCT
ecletica-1352	264	151	m.	m.	NOUN
ecletica-1352	264	152	;	;	PUNCT
ecletica-1352	264	153	ehara	ehara	PROPN
ecletica-1352	264	154	,	,	PUNCT
ecletica-1352	264	155	m.	m.	NOUN
ecletica-1352	264	156	;	;	PUNCT
ecletica-1352	264	157	toyota	toyota	PROPN
ecletica-1352	264	158	,	,	PUNCT
ecletica-1352	264	159	k.	k.	PROPN
ecletica-1352	264	160	;	;	PUNCT
ecletica-1352	264	161	fukuda	fukuda	PROPN
ecletica-1352	264	162	,	,	PUNCT
ecletica-1352	264	163	r.	r.	PROPN
ecletica-1352	264	164	;	;	PUNCT
ecletica-1352	264	165	hasagawa	hasagawa	PROPN
ecletica-1352	264	166	,	,	PUNCT
ecletica-1352	264	167	j.	j.	PROPN
ecletica-1352	264	168	;	;	PUNCT
ecletica-1352	264	169	ishida	ishida	PROPN
ecletica-1352	264	170	,	,	PUNCT
ecletica-1352	264	171	m.	m.	NOUN
ecletica-1352	264	172	;	;	PUNCT
ecletica-1352	264	173	nakajima	nakajima	PROPN
ecletica-1352	264	174	,	,	PUNCT
ecletica-1352	264	175	t.	t.	PROPN
ecletica-1352	264	176	;	;	PUNCT
ecletica-1352	264	177	honda	honda	NOUN
ecletica-1352	264	178	,	,	PUNCT
ecletica-1352	264	179	y.	y.	PROPN
ecletica-1352	264	180	;	;	PUNCT
ecletica-1352	264	181	kitao	kitao	PROPN
ecletica-1352	264	182	,	,	PUNCT
ecletica-1352	264	183	o.	o.	PROPN
ecletica-1352	264	184	nakai	nakai	PROPN
ecletica-1352	264	185	,	,	PUNCT
ecletica-1352	264	186	h.	h.	PROPN
ecletica-1352	264	187	;	;	PUNCT
ecletica-1352	264	188	vreven	vreven	VERB
ecletica-1352	264	189	,	,	PUNCT
ecletica-1352	264	190	t.	t.	NOUN
ecletica-1352	264	191	throssell	throssell	NOUN
ecletica-1352	264	192	,	,	PUNCT
ecletica-1352	264	193	k.	k.	PROPN
ecletica-1352	264	194	;	;	PUNCT
ecletica-1352	264	195	montgomery	montgomery	PROPN
ecletica-1352	264	196	,	,	PUNCT
ecletica-1352	264	197	j.	j.	PROPN
ecletica-1352	264	198	a.	a.	PROPN
ecletica-1352	264	199	;	;	PUNCT
ecletica-1352	264	200	peralta	peralta	PROPN
ecletica-1352	264	201	,	,	PUNCT
ecletica-1352	264	202	jr	jr	PROPN
ecletica-1352	264	203	,	,	PUNCT
ecletica-1352	264	204	j.	j.	PROPN
ecletica-1352	264	205	e.	e.	PROPN
ecletica-1352	264	206	;	;	PUNCT
ecletica-1352	264	207	ogliaro	ogliaro	PROPN
ecletica-1352	264	208	,	,	PUNCT
ecletica-1352	264	209	f.	f.	PROPN
ecletica-1352	264	210	;	;	PUNCT
ecletica-1352	264	211	bearpark	bearpark	PROPN
ecletica-1352	264	212	,	,	PUNCT
ecletica-1352	264	213	m.	m.	NOUN
ecletica-1352	264	214	j.	j.	PROPN
ecletica-1352	264	215	;	;	PUNCT
ecletica-1352	264	216	heyd	heyd	PROPN
ecletica-1352	264	217	,	,	PUNCT
ecletica-1352	264	218	j.	j.	PROPN
ecletica-1352	264	219	j.	j.	PROPN
ecletica-1352	264	220	;	;	PUNCT
ecletica-1352	264	221	brothers	brother	NOUN
ecletica-1352	264	222	,	,	PUNCT
ecletica-1352	264	223	e.	e.	PROPN
ecletica-1352	264	224	n.	n.	PROPN
ecletica-1352	264	225	;	;	PUNCT
ecletica-1352	264	226	kudin	kudin	PROPN
ecletica-1352	264	227	,	,	PUNCT
ecletica-1352	264	228	k.	k.	PROPN
ecletica-1352	264	229	n.	n.	PROPN
ecletica-1352	264	230	;	;	PUNCT
ecletica-1352	264	231	staroverov	staroverov	X
ecletica-1352	264	232	,	,	PUNCT
ecletica-1352	264	233	v.	v.	ADP
ecletica-1352	264	234	n.	n.	NOUN
ecletica-1352	264	235	;	;	PUNCT
ecletica-1352	264	236	keith	keith	PROPN
ecletica-1352	264	237	,	,	PUNCT
ecletica-1352	264	238	t.	t.	PROPN
ecletica-1352	264	239	a.	a.	PROPN
ecletica-1352	264	240	;	;	PUNCT
ecletica-1352	264	241	kobayashi	kobayashi	PROPN
ecletica-1352	264	242	,	,	PUNCT
ecletica-1352	264	243	r.	r.	PROPN
ecletica-1352	264	244	;	;	PUNCT
ecletica-1352	264	245	normard	normard	ADV
ecletica-1352	264	246	,	,	PUNCT
ecletica-1352	264	247	j.	j.	PROPN
ecletica-1352	264	248	;	;	PUNCT
ecletica-1352	264	249	raghavachari	raghavachari	PROPN
ecletica-1352	264	250	,	,	PUNCT
ecletica-1352	264	251	k.	k.	PROPN
ecletica-1352	264	252	;	;	PUNCT
ecletica-1352	264	253	rendell	rendell	PROPN
ecletica-1352	264	254	,	,	PUNCT
ecletica-1352	264	255	a.	a.	NOUN
ecletica-1352	264	256	p.	p.	PROPN
ecletica-1352	264	257	burant	burant	PROPN
ecletica-1352	264	258	,	,	PUNCT
ecletica-1352	264	259	j.	j.	PROPN
ecletica-1352	264	260	c.	c.	PROPN
ecletica-1352	264	261	;	;	PUNCT
ecletica-1352	264	262	iyengar	iyengar	PROPN
ecletica-1352	264	263	,	,	PUNCT
ecletica-1352	264	264	s.	s.	PROPN
ecletica-1352	264	265	s.	s.	PROPN
ecletica-1352	264	266	;	;	PUNCT
ecletica-1352	264	267	tomasi	tomasi	PROPN
ecletica-1352	264	268	,	,	PUNCT
ecletica-1352	264	269	j.	j.	PROPN
ecletica-1352	264	270	;	;	PUNCT
ecletica-1352	264	271	cossi	cossi	PROPN
ecletica-1352	264	272	,	,	PUNCT
ecletica-1352	264	273	m.	m.	NOUN
ecletica-1352	264	274	;	;	PUNCT
ecletica-1352	264	275	millam	millam	PROPN
ecletica-1352	264	276	,	,	PUNCT
ecletica-1352	264	277	j.	j.	PROPN
ecletica-1352	264	278	m.	m.	PROPN
ecletica-1352	264	279	;	;	PUNCT
ecletica-1352	264	280	klene	klene	PROPN
ecletica-1352	264	281	,	,	PUNCT
ecletica-1352	264	282	m.	m.	NOUN
ecletica-1352	264	283	;	;	PUNCT
ecletica-1352	264	284	adamo	adamo	PROPN
ecletica-1352	264	285	,	,	PUNCT
ecletica-1352	264	286	c.	c.	PROPN
ecletica-1352	264	287	;	;	PUNCT
ecletica-1352	264	288	cammi	cammi	PROPN
ecletica-1352	264	289	,	,	PUNCT
ecletica-1352	264	290	r.	r.	PROPN
ecletica-1352	264	291	;	;	PUNCT
ecletica-1352	264	292	ochterski	ochterski	PROPN
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ecletica-1352	264	294	j.	j.	PROPN
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ecletica-1352	264	297	,	,	PUNCT
ecletica-1352	264	298	r.	r.	PROPN
ecletica-1352	264	299	l.	l.	PROPN
ecletica-1352	264	300	;	;	PUNCT
ecletica-1352	264	301	morokuma	morokuma	PROPN
ecletica-1352	264	302	,	,	PUNCT
ecletica-1352	264	303	k.	k.	PROPN
ecletica-1352	264	304	farkas	farkas	PROPN
ecletica-1352	264	305	,	,	PUNCT
ecletica-1352	264	306	o.	o.	PROPN
ecletica-1352	264	307	;	;	PUNCT
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ecletica-1352	264	309	,	,	PUNCT
ecletica-1352	264	310	j.	j.	PROPN
ecletica-1352	264	311	b.	b.	PROPN
ecletica-1352	264	312	;	;	PUNCT
ecletica-1352	264	313	and	and	CCONJ
ecletica-1352	264	314	fox	fox	PROPN
ecletica-1352	264	315	,	,	PUNCT
ecletica-1352	264	316	d.	d.	PROPN
ecletica-1352	264	317	j.	j.	PROPN
ecletica-1352	264	318	;	;	PUNCT
ecletica-1352	264	319	gaussian	gaussian	PROPN
ecletica-1352	264	320	,	,	PUNCT
ecletica-1352	264	321	inc	inc	PROPN
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ecletica-1352	264	323	,	,	PUNCT
ecletica-1352	264	324	wallingford	wallingford	PROPN
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ecletica-1352	264	326	,	,	PUNCT
ecletica-1352	264	327	2016	2016	NUM
ecletica-1352	264	328	.	.	PUNCT
ecletica-1352	265	1	gber	gber	PROPN
ecletica-1352	265	2	,	,	PUNCT
ecletica-1352	265	3	t.	t.	PROPN
ecletica-1352	265	4	e.	e.	PROPN
ecletica-1352	265	5	;	;	PUNCT
ecletica-1352	265	6	louis	louis	PROPN
ecletica-1352	265	7	,	,	PUNCT
ecletica-1352	265	8	h.	h.	PROPN
ecletica-1352	265	9	;	;	PUNCT
ecletica-1352	265	10	owen	owen	PROPN
ecletica-1352	265	11	,	,	PUNCT
ecletica-1352	265	12	a.	a.	PROPN
ecletica-1352	265	13	e.	e.	PROPN
ecletica-1352	265	14	;	;	PUNCT
ecletica-1352	265	15	etinwa	etinwa	PROPN
ecletica-1352	265	16	,	,	PUNCT
ecletica-1352	265	17	b.	b.	PROPN
ecletica-1352	265	18	e.	e.	PROPN
ecletica-1352	265	19	;	;	PUNCT
ecletica-1352	265	20	benjamin	benjamin	PROPN
ecletica-1352	265	21	,	,	PUNCT
ecletica-1352	265	22	i.	i.	PROPN
ecletica-1352	265	23	;	;	PUNCT
ecletica-1352	265	24	asogwa	asogwa	PROPN
ecletica-1352	265	25	,	,	PUNCT
ecletica-1352	265	26	f.	f.	PROPN
ecletica-1352	265	27	c.	c.	PROPN
ecletica-1352	265	28	;	;	PUNCT
ecletica-1352	265	29	orosun	orosun	PROPN
ecletica-1352	265	30	,	,	PUNCT
ecletica-1352	265	31	m.	m.	NOUN
ecletica-1352	265	32	m.	m.	NOUN
ecletica-1352	265	33	;	;	PUNCT
ecletica-1352	265	34	eno	eno	PROPN
ecletica-1352	265	35	,	,	PUNCT
ecletica-1352	265	36	e.	e.	PROPN
ecletica-1352	265	37	a.	a.	PROPN
ecletica-1352	265	38	heteroatoms	heteroatoms	PROPN
ecletica-1352	265	39	(	(	PUNCT
ecletica-1352	265	40	si	si	X
ecletica-1352	265	41	,	,	PUNCT
ecletica-1352	265	42	b	b	NOUN
ecletica-1352	265	43	,	,	PUNCT
ecletica-1352	265	44	n	n	CCONJ
ecletica-1352	265	45	,	,	PUNCT
ecletica-1352	265	46	and	and	CCONJ
ecletica-1352	265	47	p	p	X
ecletica-1352	265	48	)	)	PUNCT
ecletica-1352	265	49	doped	dope	VERB
ecletica-1352	265	50	2d	2d	NUM
ecletica-1352	265	51	monolayer	monolayer	NOUN
ecletica-1352	265	52	mos2	mos2	NOUN
ecletica-1352	265	53	for	for	ADP
ecletica-1352	265	54	nh3	nh3	NOUN
ecletica-1352	265	55	gas	gas	NOUN
ecletica-1352	265	56	detection	detection	NOUN
ecletica-1352	265	57	.	.	PUNCT
ecletica-1352	266	1	rsc	rsc	PROPN
ecletica-1352	266	2	advances	advance	NOUN
ecletica-1352	266	3	.	.	PUNCT
ecletica-1352	267	1	2022	2022	NUM
ecletica-1352	267	2	,	,	PUNCT
ecletica-1352	267	3	12	12	NUM
ecletica-1352	267	4	(	(	PUNCT
ecletica-1352	267	5	40	40	NUM
ecletica-1352	267	6	)	)	PUNCT
ecletica-1352	267	7	,	,	PUNCT
ecletica-1352	267	8	25992–26010	25992–26010	NUM
ecletica-1352	267	9	.	.	PUNCT
ecletica-1352	268	1	https://doi.org/10.1039/d2ra04028j	https://doi.org/10.1039/d2ra04028j	NOUN
ecletica-1352	268	2	gupta	gupta	PROPN
ecletica-1352	268	3	,	,	PUNCT
ecletica-1352	268	4	a.	a.	NOUN
ecletica-1352	268	5	;	;	PUNCT
ecletica-1352	268	6	gupta	gupta	PROPN
ecletica-1352	268	7	,	,	PUNCT
ecletica-1352	268	8	r.	r.	PROPN
ecletica-1352	268	9	;	;	PUNCT
ecletica-1352	268	10	singh	singh	PROPN
ecletica-1352	268	11	,	,	PUNCT
ecletica-1352	268	12	r.	r.	PROPN
ecletica-1352	268	13	l.	l.	PROPN
ecletica-1352	268	14	microbes	microbes	PROPN
ecletica-1352	268	15	and	and	CCONJ
ecletica-1352	268	16	environment	environment	NOUN
ecletica-1352	268	17	.	.	PUNCT
ecletica-1352	269	1	in	in	ADP
ecletica-1352	269	2	principles	principle	NOUN
ecletica-1352	269	3	and	and	CCONJ
ecletica-1352	269	4	applications	application	NOUN
ecletica-1352	269	5	of	of	ADP
ecletica-1352	269	6	environmental	environmental	ADJ
ecletica-1352	269	7	biotechnology	biotechnology	NOUN
ecletica-1352	269	8	for	for	ADP
ecletica-1352	269	9	a	a	DET
ecletica-1352	269	10	sustainable	sustainable	ADJ
ecletica-1352	269	11	future	future	NOUN
ecletica-1352	269	12	.	.	PUNCT
ecletica-1352	269	13	springer	springer	NOUN
ecletica-1352	269	14	,	,	PUNCT
ecletica-1352	269	15	2017	2017	NUM
ecletica-1352	269	16	;	;	PUNCT
ecletica-1352	269	17	pp	pp	ADP
ecletica-1352	269	18	43–48	43–48	NUM
ecletica-1352	269	19	.	.	PUNCT
ecletica-1352	270	1	https://doi.org/10.1007/978-98110-1866-4_3	https://doi.org/10.1007/978-98110-1866-4_3	PROPN
ecletica-1352	270	2	hamdani	hamdani	PROPN
ecletica-1352	270	3	,	,	PUNCT
ecletica-1352	270	4	h.	h.	PROPN
ecletica-1352	270	5	e.	e.	PROPN
ecletica-1352	270	6	;	;	PUNCT
ecletica-1352	270	7	amane	amane	NOUN
ecletica-1352	270	8	,	,	PUNCT
ecletica-1352	270	9	m.	m.	PROPN
ecletica-1352	270	10	e.	e.	PROPN
ecletica-1352	270	11	preparation	preparation	PROPN
ecletica-1352	270	12	,	,	PUNCT
ecletica-1352	270	13	spectral	spectral	ADJ
ecletica-1352	270	14	,	,	PUNCT
ecletica-1352	270	15	antimicrobial	antimicrobial	ADJ
ecletica-1352	270	16	properties	property	NOUN
ecletica-1352	270	17	and	and	CCONJ
ecletica-1352	270	18	anticancer	anticancer	VERB
ecletica-1352	270	19	molecular	molecular	ADJ
ecletica-1352	270	20	docking	docking	NOUN
ecletica-1352	270	21	studies	study	NOUN
ecletica-1352	270	22	of	of	ADP
ecletica-1352	270	23	new	new	ADJ
ecletica-1352	270	24	metal	metal	NOUN
ecletica-1352	270	25	complexes	complex	NOUN
ecletica-1352	270	26	[	[	X
ecletica-1352	270	27	m	m	X
ecletica-1352	270	28	(	(	PUNCT
ecletica-1352	270	29	caffeine)4](pf6)2	caffeine)4](pf6)2	ADJ
ecletica-1352	270	30	;	;	PUNCT
ecletica-1352	270	31	m=	m=	X
ecletica-1352	270	32	fe	fe	X
ecletica-1352	270	33	(	(	PUNCT
ecletica-1352	270	34	ii	ii	PROPN
ecletica-1352	270	35	)	)	PUNCT
ecletica-1352	270	36	,	,	PUNCT
ecletica-1352	270	37	co	co	X
ecletica-1352	270	38	(	(	PUNCT
ecletica-1352	270	39	ii	ii	PROPN
ecletica-1352	270	40	)	)	PUNCT
ecletica-1352	270	41	,	,	PUNCT
ecletica-1352	270	42	mn	mn	PROPN
ecletica-1352	270	43	(	(	PUNCT
ecletica-1352	270	44	ii	ii	PROPN
ecletica-1352	270	45	)	)	PUNCT
ecletica-1352	270	46	,	,	PUNCT
ecletica-1352	270	47	cd	cd	PROPN
ecletica-1352	270	48	(	(	PUNCT
ecletica-1352	270	49	ii	ii	PROPN
ecletica-1352	270	50	)	)	PUNCT
ecletica-1352	270	51	,	,	PUNCT
ecletica-1352	270	52	zn	zn	PROPN
ecletica-1352	270	53	(	(	PUNCT
ecletica-1352	270	54	ii	ii	PROPN
ecletica-1352	270	55	)	)	PUNCT
ecletica-1352	270	56	,	,	PUNCT
ecletica-1352	270	57	cu	cu	PROPN
ecletica-1352	270	58	(	(	PUNCT
ecletica-1352	270	59	ii	ii	PROPN
ecletica-1352	270	60	)	)	PUNCT
ecletica-1352	270	61	,	,	PUNCT
ecletica-1352	270	62	ni	ni	PROPN
ecletica-1352	270	63	(	(	PUNCT
ecletica-1352	270	64	ii	ii	PROPN
ecletica-1352	270	65	)	)	PUNCT
ecletica-1352	270	66	.	.	PUNCT
ecletica-1352	271	1	j.	j.	PROPN
ecletica-1352	271	2	mol	mol	PROPN
ecletica-1352	271	3	.	.	PROPN
ecletica-1352	271	4	struct	struct	NOUN
ecletica-1352	271	5	.	.	PUNCT
ecletica-1352	272	1	2019	2019	NUM
ecletica-1352	272	2	,	,	PUNCT
ecletica-1352	272	3	1184	1184	NUM
ecletica-1352	272	4	,	,	PUNCT
ecletica-1352	272	5	262–270	262–270	NUM
ecletica-1352	272	6	.	.	PUNCT
ecletica-1352	273	1	https://doi.org/10.1016/j.molstruc.2019.02.049	https://doi.org/10.1016/j.molstruc.2019.02.049	PROPN
ecletica-1352	273	2	huxford	huxford	PROPN
ecletica-1352	273	3	,	,	PUNCT
ecletica-1352	273	4	r.	r.	PROPN
ecletica-1352	273	5	c.	c.	PROPN
ecletica-1352	273	6	;	;	PUNCT
ecletica-1352	273	7	della	della	PROPN
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ecletica-1352	273	9	,	,	PUNCT
ecletica-1352	273	10	j.	j.	PROPN
ecletica-1352	273	11	;	;	PUNCT
ecletica-1352	273	12	lin	lin	PROPN
ecletica-1352	273	13	,	,	PUNCT
ecletica-1352	273	14	w.	w.	PROPN
ecletica-1352	273	15	metal	metal	PROPN
ecletica-1352	273	16	–	–	PUNCT
ecletica-1352	273	17	organic	organic	ADJ
ecletica-1352	273	18	frameworks	framework	NOUN
ecletica-1352	273	19	as	as	ADP
ecletica-1352	273	20	potential	potential	ADJ
ecletica-1352	273	21	drug	drug	NOUN
ecletica-1352	273	22	carriers	carrier	NOUN
ecletica-1352	273	23	.	.	PUNCT
ecletica-1352	274	1	curr	curr	PROPN
ecletica-1352	274	2	.	.	PUNCT
ecletica-1352	275	1	opin	opin	NOUN
ecletica-1352	275	2	.	.	PUNCT
ecletica-1352	276	1	chem	chem	NOUN
ecletica-1352	276	2	.	.	PUNCT
ecletica-1352	277	1	biol	biol	PROPN
ecletica-1352	277	2	.	.	PUNCT
ecletica-1352	278	1	2010	2010	NUM
ecletica-1352	278	2	,	,	PUNCT
ecletica-1352	278	3	14	14	NUM
ecletica-1352	278	4	(	(	PUNCT
ecletica-1352	278	5	2	2	NUM
ecletica-1352	278	6	)	)	PUNCT
ecletica-1352	278	7	,	,	PUNCT
ecletica-1352	278	8	262–268	262–268	NUM
ecletica-1352	278	9	.	.	PUNCT
ecletica-1352	279	1	https://doi.org/10.1016/j.cbpa.2009.12.012	https://doi.org/10.1016/j.cbpa.2009.12.012	NOUN
ecletica-1352	279	2	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	279	3	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	279	4	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	279	5	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	279	6	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	279	7	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	279	8	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	279	9	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	279	10	https://doi.org/10.1007/s10895-022-02903-8	https://doi.org/10.1007/s10895-022-02903-8	NUM
ecletica-1352	279	11	https://doi.org/10.1107/s0907444902003451	https://doi.org/10.1107/s0907444902003451	NUM
ecletica-1352	279	12	https://doi.org/10.1107/s0907444902003451	https://doi.org/10.1107/s0907444902003451	NUM
ecletica-1352	279	13	https://doi.org/10.1107/s0907444902003451	https://doi.org/10.1107/s0907444902003451	NUM
ecletica-1352	279	14	https://doi.org/10.1107/s0907444902003451	https://doi.org/10.1107/s0907444902003451	NUM
ecletica-1352	279	15	https://doi.org/10.1107/s0907444902003451	https://doi.org/10.1107/s0907444902003451	NUM
ecletica-1352	279	16	https://doi.org/10.1107/s0907444902003451	https://doi.org/10.1107/s0907444902003451	NUM
ecletica-1352	279	17	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	NOUN
ecletica-1352	279	18	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	NOUN
ecletica-1352	279	19	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	PROPN
ecletica-1352	279	20	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	PROPN
ecletica-1352	279	21	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	PROPN
ecletica-1352	279	22	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	PROPN
ecletica-1352	279	23	https://doi.org/10.1016/j.heliyon.2020.e05783	https://doi.org/10.1016/j.heliyon.2020.e05783	PROPN
ecletica-1352	279	24	https://doi.org/10.3390/pharmaceutics12030232	https://doi.org/10.3390/pharmaceutics12030232	PROPN
ecletica-1352	280	1	https://doi.org/10.3390/pharmaceutics12030232	https://doi.org/10.3390/pharmaceutics12030232	PROPN
ecletica-1352	280	2	https://doi.org/10.3390/pharmaceutics12030232	https://doi.org/10.3390/pharmaceutics12030232	PROPN
ecletica-1352	280	3	https://doi.org/10.3390/pharmaceutics12030232	https://doi.org/10.3390/pharmaceutics12030232	PROPN
ecletica-1352	280	4	https://doi.org/10.1016/j.ccr.2021.214115	https://doi.org/10.1016/j.ccr.2021.214115	PROPN
ecletica-1352	280	5	https://doi.org/10.1016/j.ccr.2021.214115	https://doi.org/10.1016/j.ccr.2021.214115	PROPN
ecletica-1352	280	6	https://doi.org/10.1016/j.ccr.2021.214115	https://doi.org/10.1016/j.ccr.2021.214115	PROPN
ecletica-1352	280	7	https://doi.org/10.1016/j.ccr.2021.214115	https://doi.org/10.1016/j.ccr.2021.214115	PROPN
ecletica-1352	281	1	https://doi.org/10.1038/srep42717	https://doi.org/10.1038/srep42717	PROPN
ecletica-1352	281	2	https://doi.org/10.1038/srep42717	https://doi.org/10.1038/srep42717	PROPN
ecletica-1352	281	3	https://doi.org/10.1038/srep42717	https://doi.org/10.1038/srep42717	PROPN
ecletica-1352	281	4	https://doi.org/10.1038/srep42717	https://doi.org/10.1038/srep42717	PROPN
ecletica-1352	281	5	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	6	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	7	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	8	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	9	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	10	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	11	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	12	https://doi.org/10.1093/nar/gki057	https://doi.org/10.1093/nar/gki057	PROPN
ecletica-1352	281	13	https://doi.org/10.1016/j.saa.2014.02.008	https://doi.org/10.1016/j.saa.2014.02.008	PROPN
ecletica-1352	281	14	https://doi.org/10.1016/j.saa.2014.02.008	https://doi.org/10.1016/j.saa.2014.02.008	PROPN
ecletica-1352	281	15	https://doi.org/10.1016/j.saa.2014.02.008	https://doi.org/10.1016/j.saa.2014.02.008	PROPN
ecletica-1352	281	16	https://doi.org/10.1016/j.saa.2014.02.008	https://doi.org/10.1016/j.saa.2014.02.008	PROPN
ecletica-1352	281	17	https://doi.org/10.1016/j.saa.2014.02.008	https://doi.org/10.1016/j.saa.2014.02.008	PROPN
ecletica-1352	281	18	https://doi.org/10.1016/j.saa.2014.02.008	https://doi.org/10.1016/j.saa.2014.02.008	X
ecletica-1352	281	19	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	X
ecletica-1352	281	20	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	AUX
ecletica-1352	281	21	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	X
ecletica-1352	282	1	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	AUX
ecletica-1352	282	2	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	X
ecletica-1352	283	1	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	X
ecletica-1352	284	1	https://doi.org/10.1080/10406638.2022.2110908	https://doi.org/10.1080/10406638.2022.2110908	X
ecletica-1352	284	2	https://doi.org/10.1016/j.jil.2022.100030	https://doi.org/10.1016/j.jil.2022.100030	PROPN
ecletica-1352	284	3	https://doi.org/10.1016/j.jil.2022.100030	https://doi.org/10.1016/j.jil.2022.100030	PROPN
ecletica-1352	284	4	https://doi.org/10.1016/j.jil.2022.100030	https://doi.org/10.1016/j.jil.2022.100030	PROPN
ecletica-1352	284	5	https://doi.org/10.1016/j.jil.2022.100030	https://doi.org/10.1016/j.jil.2022.100030	PROPN
ecletica-1352	284	6	https://doi.org/10.1016/j.jil.2022.100030	https://doi.org/10.1016/j.jil.2022.100030	PROPN
ecletica-1352	284	7	https://doi.org/10.1016/j.jil.2022.100030	https://doi.org/10.1016/j.jil.2022.100030	PROPN
ecletica-1352	285	1	https://doi.org/10.1039/d2ra04028j	https://doi.org/10.1039/d2ra04028j	PROPN
ecletica-1352	285	2	https://doi.org/10.1039/d2ra04028j	https://doi.org/10.1039/d2ra04028j	PROPN
ecletica-1352	285	3	https://doi.org/10.1039/d2ra04028j	https://doi.org/10.1039/d2ra04028j	PROPN
ecletica-1352	285	4	https://doi.org/10.1039/d2ra04028j	https://doi.org/10.1039/d2ra04028j	PROPN
ecletica-1352	285	5	https://doi.org/10.1039/d2ra04028j	https://doi.org/10.1039/d2ra04028j	NOUN
ecletica-1352	285	6	https://doi.org/10.1007/978-981-10-1866-4_3	https://doi.org/10.1007/978-981-10-1866-4_3	ADP
ecletica-1352	285	7	https://doi.org/10.1007/978-981-10-1866-4_3	https://doi.org/10.1007/978-981-10-1866-4_3	ADP
ecletica-1352	285	8	https://doi.org/10.1007/978-981-10-1866-4_3	https://doi.org/10.1007/978-981-10-1866-4_3	ADP
ecletica-1352	285	9	https://doi.org/10.1007/978-981-10-1866-4_3	https://doi.org/10.1007/978-981-10-1866-4_3	ADP
ecletica-1352	285	10	https://doi.org/10.1007/978-981-10-1866-4_3	https://doi.org/10.1007/978-981-10-1866-4_3	PROPN
ecletica-1352	285	11	https://doi.org/10.1016/j.molstruc.2019.02.049	https://doi.org/10.1016/j.molstruc.2019.02.049	PROPN
ecletica-1352	285	12	https://doi.org/10.1016/j.molstruc.2019.02.049	https://doi.org/10.1016/j.molstruc.2019.02.049	PROPN
ecletica-1352	285	13	https://doi.org/10.1016/j.molstruc.2019.02.049	https://doi.org/10.1016/j.molstruc.2019.02.049	PROPN
ecletica-1352	285	14	https://doi.org/10.1016/j.molstruc.2019.02.049	https://doi.org/10.1016/j.molstruc.2019.02.049	PROPN
ecletica-1352	285	15	https://doi.org/10.1016/j.molstruc.2019.02.049	https://doi.org/10.1016/j.molstruc.2019.02.049	PROPN
ecletica-1352	285	16	https://doi.org/10.1016/j.molstruc.2019.02.049	https://doi.org/10.1016/j.molstruc.2019.02.049	PROPN
ecletica-1352	285	17	https://doi.org/10.1016/j.cbpa.2009.12.012	https://doi.org/10.1016/j.cbpa.2009.12.012	PROPN
ecletica-1352	285	18	https://doi.org/10.1016/j.cbpa.2009.12.012	https://doi.org/10.1016/j.cbpa.2009.12.012	PROPN
ecletica-1352	285	19	https://doi.org/10.1016/j.cbpa.2009.12.012	https://doi.org/10.1016/j.cbpa.2009.12.012	NOUN
ecletica-1352	285	20	https://doi.org/10.1016/j.cbpa.2009.12.012	https://doi.org/10.1016/j.cbpa.2009.12.012	NOUN
ecletica-1352	285	21	original	original	ADJ
ecletica-1352	285	22	article	article	NOUN
ecletica-1352	285	23	revista.iq.unesp.br	revista.iq.unesp.br	PUNCT
ecletica-1352	285	24	49	49	NUM
ecletica-1352	285	25	eclética	eclética	PROPN
ecletica-1352	285	26	química	química	PROPN
ecletica-1352	285	27	journal	journal	PROPN
ecletica-1352	285	28	,	,	PUNCT
ecletica-1352	285	29	vol	vol	NOUN
ecletica-1352	285	30	.	.	PROPN
ecletica-1352	285	31	47	47	NUM
ecletica-1352	285	32	,	,	PUNCT
ecletica-1352	285	33	n.	n.	NOUN
ecletica-1352	285	34	4	4	NUM
ecletica-1352	285	35	,	,	PUNCT
ecletica-1352	285	36	2022	2022	NUM
ecletica-1352	285	37	,	,	PUNCT
ecletica-1352	285	38	37	37	NUM
ecletica-1352	285	39	-	-	SYM
ecletica-1352	285	40	50	50	NUM
ecletica-1352	285	41	issn	issn	NOUN
ecletica-1352	285	42	:	:	PUNCT
ecletica-1352	285	43	1678	1678	NUM
ecletica-1352	285	44	-	-	SYM
ecletica-1352	285	45	4618	4618	NUM
ecletica-1352	285	46	doi	doi	NOUN
ecletica-1352	285	47	:	:	PUNCT
ecletica-1352	285	48	10.26850/1678	10.26850/1678	NUM
ecletica-1352	285	49	-	-	PUNCT
ecletica-1352	285	50	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	VERB
ecletica-1352	285	51	-	-	PUNCT
ecletica-1352	285	52	50	50	NUM
ecletica-1352	285	53	isravel	isravel	NOUN
ecletica-1352	285	54	,	,	PUNCT
ecletica-1352	285	55	a.	a.	PROPN
ecletica-1352	285	56	d.	d.	PROPN
ecletica-1352	285	57	;	;	PUNCT
ecletica-1352	285	58	jeyaraj	jeyaraj	PROPN
ecletica-1352	285	59	,	,	PUNCT
ecletica-1352	285	60	j.	j.	PROPN
ecletica-1352	285	61	k.	k.	PROPN
ecletica-1352	285	62	;	;	PUNCT
ecletica-1352	285	63	thangasamy	thangasamy	PROPN
ecletica-1352	285	64	,	,	PUNCT
ecletica-1352	285	65	s.	s.	PROPN
ecletica-1352	285	66	;	;	PUNCT
ecletica-1352	285	67	john	john	PROPN
ecletica-1352	285	68	,	,	PUNCT
ecletica-1352	285	69	w.	w.	PROPN
ecletica-1352	285	70	j.	j.	PROPN
ecletica-1352	285	71	dft	dft	PROPN
ecletica-1352	285	72	,	,	PUNCT
ecletica-1352	285	73	nbo	nbo	PROPN
ecletica-1352	285	74	,	,	PUNCT
ecletica-1352	285	75	homo	homo	NOUN
ecletica-1352	285	76	-	-	PUNCT
ecletica-1352	285	77	lumo	lumo	NOUN
ecletica-1352	285	78	,	,	PUNCT
ecletica-1352	285	79	nci	nci	PROPN
ecletica-1352	285	80	,	,	PUNCT
ecletica-1352	285	81	stability	stability	NOUN
ecletica-1352	285	82	,	,	PUNCT
ecletica-1352	285	83	fukui	fukui	PROPN
ecletica-1352	285	84	function	function	NOUN
ecletica-1352	285	85	and	and	CCONJ
ecletica-1352	285	86	hole	hole	NOUN
ecletica-1352	285	87	–	–	PUNCT
ecletica-1352	285	88	electron	electron	NOUN
ecletica-1352	285	89	analyses	analysis	NOUN
ecletica-1352	285	90	of	of	ADP
ecletica-1352	285	91	tolcapone	tolcapone	NOUN
ecletica-1352	285	92	.	.	PUNCT
ecletica-1352	286	1	comput	comput	NOUN
ecletica-1352	286	2	.	.	PUNCT
ecletica-1352	287	1	theor	theor	PROPN
ecletica-1352	287	2	.	.	PUNCT
ecletica-1352	287	3	chem	chem	PROPN
ecletica-1352	287	4	.	.	PUNCT
ecletica-1352	288	1	2021	2021	NUM
ecletica-1352	288	2	,	,	PUNCT
ecletica-1352	288	3	1202	1202	NUM
ecletica-1352	288	4	,	,	PUNCT
ecletica-1352	288	5	113296	113296	NUM
ecletica-1352	288	6	.	.	PUNCT
ecletica-1352	289	1	https://doi.org/10.1016/j.comptc.2021.113296	https://doi.org/10.1016/j.comptc.2021.113296	PROPN
ecletica-1352	289	2	izuchukwu	izuchukwu	PROPN
ecletica-1352	289	3	,	,	PUNCT
ecletica-1352	289	4	u.	u.	PROPN
ecletica-1352	289	5	d.	d.	PROPN
ecletica-1352	289	6	;	;	PUNCT
ecletica-1352	289	7	asogwa	asogwa	PROPN
ecletica-1352	289	8	,	,	PUNCT
ecletica-1352	289	9	f.	f.	PROPN
ecletica-1352	289	10	c.	c.	PROPN
ecletica-1352	289	11	;	;	PUNCT
ecletica-1352	289	12	louis	louis	PROPN
ecletica-1352	289	13	,	,	PUNCT
ecletica-1352	289	14	h.	h.	PROPN
ecletica-1352	289	15	;	;	PUNCT
ecletica-1352	289	16	uchenna	uchenna	PROPN
ecletica-1352	289	17	,	,	PUNCT
ecletica-1352	289	18	e.	e.	PROPN
ecletica-1352	289	19	f.	f.	PROPN
ecletica-1352	289	20	;	;	PUNCT
ecletica-1352	289	21	gber	gber	PROPN
ecletica-1352	289	22	,	,	PUNCT
ecletica-1352	289	23	t.	t.	PROPN
ecletica-1352	289	24	e.	e.	PROPN
ecletica-1352	289	25	;	;	PUNCT
ecletica-1352	289	26	chinasa	chinasa	PROPN
ecletica-1352	289	27	,	,	PUNCT
ecletica-1352	289	28	u.	u.	PROPN
ecletica-1352	289	29	m.	m.	PROPN
ecletica-1352	289	30	;	;	PUNCT
ecletica-1352	289	31	chinedum	chinedum	PROPN
ecletica-1352	289	32	,	,	PUNCT
ecletica-1352	289	33	n.	n.	PROPN
ecletica-1352	289	34	j.	j.	PROPN
ecletica-1352	289	35	;	;	PUNCT
ecletica-1352	289	36	eze	eze	PROPN
ecletica-1352	289	37	,	,	PUNCT
ecletica-1352	289	38	b.	b.	PROPN
ecletica-1352	289	39	o.	o.	PROPN
ecletica-1352	289	40	;	;	PUNCT
ecletica-1352	289	41	adeyinka	adeyinka	ADV
ecletica-1352	289	42	,	,	PUNCT
ecletica-1352	289	43	a.	a.	PROPN
ecletica-1352	289	44	s.	s.	PROPN
ecletica-1352	289	45	;	;	PUNCT
ecletica-1352	289	46	chris	chris	PROPN
ecletica-1352	289	47	,	,	PUNCT
ecletica-1352	289	48	o.	o.	PROPN
ecletica-1352	289	49	u.	u.	PROPN
ecletica-1352	289	50	synthesis	synthesis	PROPN
ecletica-1352	289	51	,	,	PUNCT
ecletica-1352	289	52	vibrational	vibrational	ADJ
ecletica-1352	289	53	analysis	analysis	NOUN
ecletica-1352	289	54	,	,	PUNCT
ecletica-1352	289	55	molecular	molecular	ADJ
ecletica-1352	289	56	property	property	NOUN
ecletica-1352	289	57	investigation	investigation	NOUN
ecletica-1352	289	58	,	,	PUNCT
ecletica-1352	289	59	and	and	CCONJ
ecletica-1352	289	60	molecular	molecular	ADJ
ecletica-1352	289	61	docking	docking	NOUN
ecletica-1352	289	62	of	of	ADP
ecletica-1352	289	63	new	new	ADJ
ecletica-1352	289	64	benzenesulphonamide	benzenesulphonamide	NOUN
ecletica-1352	289	65	-	-	PUNCT
ecletica-1352	289	66	based	base	VERB
ecletica-1352	289	67	carboxamide	carboxamide	NOUN
ecletica-1352	289	68	derivatives	derivative	NOUN
ecletica-1352	289	69	against	against	ADP
ecletica-1352	289	70	plasmodium	plasmodium	NOUN
ecletica-1352	289	71	falciparum	falciparum	NOUN
ecletica-1352	289	72	.	.	PUNCT
ecletica-1352	290	1	journal	journal	NOUN
ecletica-1352	290	2	of	of	ADP
ecletica-1352	290	3	molecular	molecular	ADJ
ecletica-1352	290	4	structure	structure	NOUN
ecletica-1352	290	5	.	.	PUNCT
ecletica-1352	291	1	2022	2022	NUM
ecletica-1352	291	2	,	,	PUNCT
ecletica-1352	291	3	1269	1269	NUM
ecletica-1352	291	4	,	,	PUNCT
ecletica-1352	291	5	133796	133796	NUM
ecletica-1352	291	6	.	.	PUNCT
ecletica-1352	292	1	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	292	2	jia	jia	PROPN
ecletica-1352	292	3	,	,	PUNCT
ecletica-1352	292	4	c.-y	c.-y	NOUN
ecletica-1352	292	5	.	.	PUNCT
ecletica-1352	292	6	;	;	PUNCT
ecletica-1352	292	7	li	li	PROPN
ecletica-1352	292	8	,	,	PUNCT
ecletica-1352	292	9	j.-y	j.-y	PROPN
ecletica-1352	292	10	.	.	PUNCT
ecletica-1352	292	11	;	;	PUNCT
ecletica-1352	292	12	hao	hao	PROPN
ecletica-1352	292	13	,	,	PUNCT
ecletica-1352	292	14	g.-f	g.-f	NOUN
ecletica-1352	292	15	.	.	PUNCT
ecletica-1352	292	16	;	;	PUNCT
ecletica-1352	292	17	yang	yang	PROPN
ecletica-1352	292	18	,	,	PUNCT
ecletica-1352	292	19	g.-f	g.-f	NOUN
ecletica-1352	292	20	.	.	PUNCT
ecletica-1352	293	1	a	a	DET
ecletica-1352	293	2	drug	drug	NOUN
ecletica-1352	293	3	-	-	PUNCT
ecletica-1352	293	4	likeness	likeness	NOUN
ecletica-1352	293	5	toolbox	toolbox	NOUN
ecletica-1352	293	6	facilitates	facilitate	VERB
ecletica-1352	293	7	admet	admet	PROPN
ecletica-1352	293	8	study	study	PROPN
ecletica-1352	293	9	in	in	ADP
ecletica-1352	293	10	drug	drug	NOUN
ecletica-1352	293	11	discovery	discovery	NOUN
ecletica-1352	293	12	.	.	PUNCT
ecletica-1352	294	1	drug	drug	NOUN
ecletica-1352	294	2	discov	discov	NOUN
ecletica-1352	294	3	.	.	PUNCT
ecletica-1352	295	1	today	today	NOUN
ecletica-1352	295	2	.	.	PUNCT
ecletica-1352	296	1	2020	2020	NUM
ecletica-1352	296	2	,	,	PUNCT
ecletica-1352	296	3	25	25	NUM
ecletica-1352	296	4	(	(	PUNCT
ecletica-1352	296	5	1	1	NUM
ecletica-1352	296	6	)	)	PUNCT
ecletica-1352	296	7	,	,	PUNCT
ecletica-1352	296	8	248–258	248–258	NUM
ecletica-1352	296	9	.	.	PUNCT
ecletica-1352	297	1	https://doi.org/10.1016/j.drudis.2019.10.014	https://doi.org/10.1016/j.drudis.2019.10.014	PROPN
ecletica-1352	297	2	kar	kar	PROPN
ecletica-1352	297	3	,	,	PUNCT
ecletica-1352	297	4	s.	s.	PROPN
ecletica-1352	297	5	;	;	PUNCT
ecletica-1352	297	6	leszczynski	leszczynski	PROPN
ecletica-1352	297	7	,	,	PUNCT
ecletica-1352	297	8	j.	j.	PROPN
ecletica-1352	297	9	open	open	ADJ
ecletica-1352	297	10	access	access	NOUN
ecletica-1352	297	11	in	in	ADP
ecletica-1352	297	12	silico	silico	NOUN
ecletica-1352	297	13	tools	tool	NOUN
ecletica-1352	297	14	to	to	PART
ecletica-1352	297	15	predict	predict	VERB
ecletica-1352	297	16	the	the	DET
ecletica-1352	297	17	admet	admet	NOUN
ecletica-1352	297	18	profiling	profiling	NOUN
ecletica-1352	297	19	of	of	ADP
ecletica-1352	297	20	drug	drug	NOUN
ecletica-1352	297	21	candidates	candidate	NOUN
ecletica-1352	297	22	.	.	PUNCT
ecletica-1352	298	1	expert	expert	NOUN
ecletica-1352	298	2	opin	opin	NOUN
ecletica-1352	298	3	.	.	PUNCT
ecletica-1352	299	1	drug	drug	NOUN
ecletica-1352	299	2	discov	discov	NOUN
ecletica-1352	299	3	.	.	PUNCT
ecletica-1352	300	1	2020	2020	NUM
ecletica-1352	300	2	,	,	PUNCT
ecletica-1352	300	3	15	15	NUM
ecletica-1352	300	4	(	(	PUNCT
ecletica-1352	300	5	12	12	NUM
ecletica-1352	300	6	)	)	PUNCT
ecletica-1352	300	7	,	,	PUNCT
ecletica-1352	300	8	1473–1487	1473–1487	NUM
ecletica-1352	300	9	.	.	PUNCT
ecletica-1352	301	1	https://doi.org/10.1080/17460441.2020.1798926	https://doi.org/10.1080/17460441.2020.1798926	PROPN
ecletica-1352	301	2	kavimani	kavimani	ADJ
ecletica-1352	301	3	,	,	PUNCT
ecletica-1352	301	4	m.	m.	NOUN
ecletica-1352	301	5	;	;	PUNCT
ecletica-1352	301	6	balachandran	balachandran	NOUN
ecletica-1352	301	7	,	,	PUNCT
ecletica-1352	301	8	v.	v.	PROPN
ecletica-1352	301	9	;	;	PUNCT
ecletica-1352	301	10	narayana	narayana	PROPN
ecletica-1352	301	11	,	,	PUNCT
ecletica-1352	301	12	b.	b.	PROPN
ecletica-1352	301	13	;	;	PUNCT
ecletica-1352	301	14	vanasundari	vanasundari	X
ecletica-1352	301	15	,	,	PUNCT
ecletica-1352	301	16	k.	k.	PROPN
ecletica-1352	301	17	;	;	PUNCT
ecletica-1352	301	18	revathi	revathi	PROPN
ecletica-1352	301	19	,	,	PUNCT
ecletica-1352	301	20	b.	b.	PROPN
ecletica-1352	301	21	topological	topological	ADJ
ecletica-1352	301	22	analysis	analysis	NOUN
ecletica-1352	301	23	(	(	PUNCT
ecletica-1352	301	24	bcp	bcp	NOUN
ecletica-1352	301	25	)	)	PUNCT
ecletica-1352	301	26	of	of	ADP
ecletica-1352	301	27	vibrational	vibrational	ADJ
ecletica-1352	301	28	spectroscopic	spectroscopic	ADJ
ecletica-1352	301	29	studies	study	NOUN
ecletica-1352	301	30	,	,	PUNCT
ecletica-1352	301	31	docking	docking	NOUN
ecletica-1352	301	32	,	,	PUNCT
ecletica-1352	301	33	rdg	rdg	NOUN
ecletica-1352	301	34	,	,	PUNCT
ecletica-1352	301	35	dssc	dssc	PROPN
ecletica-1352	301	36	,	,	PUNCT
ecletica-1352	301	37	fukui	fukui	PROPN
ecletica-1352	301	38	functions	function	NOUN
ecletica-1352	301	39	and	and	CCONJ
ecletica-1352	301	40	chemical	chemical	NOUN
ecletica-1352	301	41	reactivity	reactivity	NOUN
ecletica-1352	301	42	of	of	ADP
ecletica-1352	301	43	2	2	NUM
ecletica-1352	301	44	-	-	PUNCT
ecletica-1352	301	45	methylphenylacetic	methylphenylacetic	ADJ
ecletica-1352	301	46	acid	acid	NOUN
ecletica-1352	301	47	.	.	PUNCT
ecletica-1352	302	1	spectrochim	spectrochim	PROPN
ecletica-1352	302	2	.	.	PUNCT
ecletica-1352	303	1	acta	acta	PROPN
ecletica-1352	303	2	a	a	DET
ecletica-1352	303	3	mol	mol	PROPN
ecletica-1352	303	4	.	.	PROPN
ecletica-1352	303	5	biomol	biomol	PROPN
ecletica-1352	303	6	.	.	PUNCT
ecletica-1352	304	1	spectrosc	spectrosc	PROPN
ecletica-1352	304	2	.	.	PUNCT
ecletica-1352	305	1	2018	2018	NUM
ecletica-1352	305	2	,	,	PUNCT
ecletica-1352	305	3	190	190	NUM
ecletica-1352	305	4	,	,	PUNCT
ecletica-1352	305	5	47	47	NUM
ecletica-1352	305	6	–	–	SYM
ecletica-1352	305	7	60	60	NUM
ecletica-1352	305	8	.	.	PUNCT
ecletica-1352	306	1	https://doi.org/10.1016/j.saa.2017.09.005	https://doi.org/10.1016/j.saa.2017.09.005	PROPN
ecletica-1352	306	2	khan	khan	PROPN
ecletica-1352	306	3	,	,	PUNCT
ecletica-1352	306	4	e.	e.	PROPN
ecletica-1352	306	5	;	;	PUNCT
ecletica-1352	306	6	khalid	khalid	PROPN
ecletica-1352	306	7	,	,	PUNCT
ecletica-1352	306	8	m.	m.	NOUN
ecletica-1352	306	9	;	;	PUNCT
ecletica-1352	306	10	gul	gul	PROPN
ecletica-1352	306	11	,	,	PUNCT
ecletica-1352	306	12	z.	z.	PROPN
ecletica-1352	306	13	;	;	PUNCT
ecletica-1352	306	14	shahzad	shahzad	PROPN
ecletica-1352	306	15	,	,	PUNCT
ecletica-1352	306	16	a.	a.	PROPN
ecletica-1352	306	17	;	;	PUNCT
ecletica-1352	306	18	tahir	tahir	PROPN
ecletica-1352	306	19	,	,	PUNCT
ecletica-1352	306	20	m.	m.	NOUN
ecletica-1352	306	21	n.	n.	PROPN
ecletica-1352	306	22	;	;	PUNCT
ecletica-1352	306	23	asif	asif	NOUN
ecletica-1352	306	24	,	,	PUNCT
ecletica-1352	306	25	h.	h.	PROPN
ecletica-1352	306	26	m.	m.	PROPN
ecletica-1352	306	27	;	;	PUNCT
ecletica-1352	306	28	asim	asim	PROPN
ecletica-1352	306	29	,	,	PUNCT
ecletica-1352	306	30	s.	s.	PROPN
ecletica-1352	306	31	;	;	PUNCT
ecletica-1352	306	32	braga	braga	NOUN
ecletica-1352	306	33	,	,	PUNCT
ecletica-1352	306	34	a.	a.	PROPN
ecletica-1352	306	35	c.	c.	PROPN
ecletica-1352	306	36	molecular	molecular	ADJ
ecletica-1352	306	37	structure	structure	NOUN
ecletica-1352	306	38	of	of	ADP
ecletica-1352	306	39	1	1	NUM
ecletica-1352	306	40	,	,	PUNCT
ecletica-1352	306	41	4	4	NUM
ecletica-1352	306	42	-	-	PUNCT
ecletica-1352	306	43	bis	bis	ADJ
ecletica-1352	306	44	(	(	PUNCT
ecletica-1352	306	45	substituted	substitute	VERB
ecletica-1352	306	46	-	-	PUNCT
ecletica-1352	306	47	carbonyl	carbonyl	NOUN
ecletica-1352	306	48	)	)	PUNCT
ecletica-1352	306	49	benzene	benzene	NOUN
ecletica-1352	306	50	:	:	PUNCT
ecletica-1352	306	51	a	a	DET
ecletica-1352	306	52	combined	combined	ADJ
ecletica-1352	306	53	experimental	experimental	ADJ
ecletica-1352	306	54	and	and	CCONJ
ecletica-1352	306	55	theoretical	theoretical	ADJ
ecletica-1352	306	56	approach	approach	NOUN
ecletica-1352	306	57	.	.	PUNCT
ecletica-1352	307	1	j.	j.	PROPN
ecletica-1352	307	2	mol	mol	PROPN
ecletica-1352	307	3	.	.	PROPN
ecletica-1352	307	4	struct	struct	NOUN
ecletica-1352	307	5	.	.	PUNCT
ecletica-1352	308	1	2020	2020	NUM
ecletica-1352	308	2	,	,	PUNCT
ecletica-1352	308	3	1205	1205	NUM
ecletica-1352	308	4	,	,	PUNCT
ecletica-1352	308	5	127633	127633	NUM
ecletica-1352	308	6	.	.	PUNCT
ecletica-1352	309	1	https://doi.org/10.1016/j.molstruc.2019.127633	https://doi.org/10.1016/j.molstruc.2019.127633	PROPN
ecletica-1352	309	2	kiran	kiran	PROPN
ecletica-1352	309	3	,	,	PUNCT
ecletica-1352	309	4	g.	g.	PROPN
ecletica-1352	309	5	;	;	PUNCT
ecletica-1352	309	6	karthik	karthik	PROPN
ecletica-1352	309	7	,	,	PUNCT
ecletica-1352	309	8	l.	l.	PROPN
ecletica-1352	309	9	;	;	PUNCT
ecletica-1352	309	10	devi	devi	PROPN
ecletica-1352	309	11	,	,	PUNCT
ecletica-1352	309	12	m.	m.	NOUN
ecletica-1352	309	13	s.	s.	PROPN
ecletica-1352	309	14	s.	s.	PROPN
ecletica-1352	309	15	;	;	PUNCT
ecletica-1352	309	16	sathiyarajeswaran	sathiyarajeswaran	ADJ
ecletica-1352	309	17	,	,	PUNCT
ecletica-1352	309	18	p.	p.	NOUN
ecletica-1352	309	19	;	;	PUNCT
ecletica-1352	309	20	kanakavalli	kanakavalli	PROPN
ecletica-1352	309	21	,	,	PUNCT
ecletica-1352	309	22	k.	k.	PROPN
ecletica-1352	309	23	;	;	PUNCT
ecletica-1352	309	24	kumar	kumar	PROPN
ecletica-1352	309	25	,	,	PUNCT
ecletica-1352	309	26	k.	k.	PROPN
ecletica-1352	309	27	m.	m.	PROPN
ecletica-1352	309	28	;	;	PUNCT
ecletica-1352	309	29	kumar	kumar	PROPN
ecletica-1352	309	30	,	,	PUNCT
ecletica-1352	309	31	d.	d.	PROPN
ecletica-1352	309	32	r.	r.	PROPN
ecletica-1352	309	33	in	in	ADP
ecletica-1352	309	34	silico	silico	NOUN
ecletica-1352	309	35	computational	computational	ADJ
ecletica-1352	309	36	screening	screening	NOUN
ecletica-1352	309	37	of	of	ADP
ecletica-1352	309	38	kabasura	kabasura	PROPN
ecletica-1352	309	39	kudineer	kudineer	PROPN
ecletica-1352	309	40	official	official	PROPN
ecletica-1352	309	41	siddha	siddha	PROPN
ecletica-1352	309	42	formulation	formulation	PROPN
ecletica-1352	309	43	and	and	CCONJ
ecletica-1352	309	44	jacom	jacom	NOUN
ecletica-1352	309	45	against	against	ADP
ecletica-1352	309	46	sars	sar	NOUN
ecletica-1352	309	47	-	-	PUNCT
ecletica-1352	309	48	cov-2	cov-2	NOUN
ecletica-1352	309	49	spike	spike	ADJ
ecletica-1352	309	50	protein	protein	NOUN
ecletica-1352	309	51	.	.	PUNCT
ecletica-1352	310	1	j.	j.	PROPN
ecletica-1352	310	2	ayurveda	ayurveda	PROPN
ecletica-1352	310	3	integr	integr	PROPN
ecletica-1352	310	4	.	.	PUNCT
ecletica-1352	311	1	med	med	PROPN
ecletica-1352	311	2	.	.	PUNCT
ecletica-1352	312	1	2020	2020	NUM
ecletica-1352	312	2	,	,	PUNCT
ecletica-1352	312	3	13	13	NUM
ecletica-1352	312	4	(	(	PUNCT
ecletica-1352	312	5	1	1	NUM
ecletica-1352	312	6	)	)	PUNCT
ecletica-1352	312	7	,	,	PUNCT
ecletica-1352	312	8	100324	100324	NUM
ecletica-1352	312	9	.	.	PUNCT
ecletica-1352	313	1	https://doi.org/10.1016/j.jaim.2020.05.009	https://doi.org/10.1016/j.jaim.2020.05.009	PROPN
ecletica-1352	313	2	konakanchi	konakanchi	PROPN
ecletica-1352	313	3	,	,	PUNCT
ecletica-1352	313	4	r.	r.	PROPN
ecletica-1352	313	5	;	;	PUNCT
ecletica-1352	313	6	haribabu	haribabu	PROPN
ecletica-1352	313	7	,	,	PUNCT
ecletica-1352	313	8	j.	j.	PROPN
ecletica-1352	313	9	;	;	PUNCT
ecletica-1352	313	10	prashanth	prashanth	PROPN
ecletica-1352	313	11	,	,	PUNCT
ecletica-1352	313	12	j.	j.	PROPN
ecletica-1352	313	13	;	;	PUNCT
ecletica-1352	313	14	nishtala	nishtala	PROPN
ecletica-1352	313	15	,	,	PUNCT
ecletica-1352	313	16	v.	v.	PROPN
ecletica-1352	313	17	b.	b.	PROPN
ecletica-1352	313	18	;	;	PUNCT
ecletica-1352	313	19	mallela	mallela	PROPN
ecletica-1352	313	20	,	,	PUNCT
ecletica-1352	313	21	r.	r.	PROPN
ecletica-1352	313	22	;	;	PUNCT
ecletica-1352	313	23	manchala	manchala	PROPN
ecletica-1352	313	24	,	,	PUNCT
ecletica-1352	313	25	s.	s.	PROPN
ecletica-1352	313	26	;	;	PUNCT
ecletica-1352	313	27	gandamalla	gandamalla	PROPN
ecletica-1352	313	28	,	,	PUNCT
ecletica-1352	313	29	d.	d.	PROPN
ecletica-1352	313	30	;	;	PUNCT
ecletica-1352	313	31	karvembu	karvembu	PROPN
ecletica-1352	313	32	,	,	PUNCT
ecletica-1352	313	33	r.	r.	PROPN
ecletica-1352	313	34	;	;	PUNCT
ecletica-1352	313	35	reddy	reddy	PROPN
ecletica-1352	313	36	,	,	PUNCT
ecletica-1352	313	37	b.	b.	PROPN
ecletica-1352	313	38	v.	v.	PROPN
ecletica-1352	313	39	;	;	PUNCT
ecletica-1352	313	40	yellu	yellu	NOUN
ecletica-1352	313	41	,	,	PUNCT
ecletica-1352	313	42	n.	n.	PROPN
ecletica-1352	313	43	r.	r.	PROPN
ecletica-1352	313	44	;	;	PUNCT
ecletica-1352	313	45	kotha	kotha	PROPN
ecletica-1352	313	46	,	,	PUNCT
ecletica-1352	313	47	l.	l.	PROPN
ecletica-1352	313	48	r.	r.	PROPN
ecletica-1352	313	49	synthesis	synthesis	PROPN
ecletica-1352	313	50	,	,	PUNCT
ecletica-1352	313	51	structural	structural	ADJ
ecletica-1352	313	52	,	,	PUNCT
ecletica-1352	313	53	biological	biological	ADJ
ecletica-1352	313	54	evaluation	evaluation	NOUN
ecletica-1352	313	55	,	,	PUNCT
ecletica-1352	313	56	molecular	molecular	ADJ
ecletica-1352	313	57	docking	docking	NOUN
ecletica-1352	313	58	and	and	CCONJ
ecletica-1352	313	59	dft	dft	PROPN
ecletica-1352	313	60	studies	study	NOUN
ecletica-1352	313	61	of	of	ADP
ecletica-1352	313	62	co	co	PROPN
ecletica-1352	313	63	(	(	PUNCT
ecletica-1352	313	64	ii	ii	PROPN
ecletica-1352	313	65	)	)	PUNCT
ecletica-1352	313	66	,	,	PUNCT
ecletica-1352	313	67	ni	ni	PROPN
ecletica-1352	313	68	(	(	PUNCT
ecletica-1352	313	69	ii	ii	PROPN
ecletica-1352	313	70	)	)	PUNCT
ecletica-1352	313	71	,	,	PUNCT
ecletica-1352	313	72	cu	cu	PROPN
ecletica-1352	313	73	(	(	PUNCT
ecletica-1352	313	74	ii	ii	PROPN
ecletica-1352	313	75	)	)	PUNCT
ecletica-1352	313	76	,	,	PUNCT
ecletica-1352	313	77	zn	zn	PROPN
ecletica-1352	313	78	(	(	PUNCT
ecletica-1352	313	79	ii	ii	PROPN
ecletica-1352	313	80	)	)	PUNCT
ecletica-1352	313	81	,	,	PUNCT
ecletica-1352	313	82	cd	cd	PROPN
ecletica-1352	313	83	(	(	PUNCT
ecletica-1352	313	84	ii	ii	PROPN
ecletica-1352	313	85	)	)	PUNCT
ecletica-1352	313	86	and	and	CCONJ
ecletica-1352	313	87	hg	hg	PROPN
ecletica-1352	313	88	(	(	PUNCT
ecletica-1352	313	89	ii	ii	NOUN
ecletica-1352	313	90	)	)	PUNCT
ecletica-1352	313	91	complexes	complex	NOUN
ecletica-1352	313	92	bearing	bear	VERB
ecletica-1352	313	93	heterocyclic	heterocyclic	ADJ
ecletica-1352	313	94	thiosemicarbazone	thiosemicarbazone	NOUN
ecletica-1352	313	95	ligand	ligand	NOUN
ecletica-1352	313	96	.	.	PUNCT
ecletica-1352	314	1	appl	appl	PROPN
ecletica-1352	314	2	.	.	PUNCT
ecletica-1352	315	1	organomet	organomet	PROPN
ecletica-1352	315	2	.	.	PUNCT
ecletica-1352	316	1	chem	chem	NOUN
ecletica-1352	316	2	.	.	PUNCT
ecletica-1352	317	1	2018	2018	NUM
ecletica-1352	317	2	,	,	PUNCT
ecletica-1352	317	3	32	32	NUM
ecletica-1352	317	4	(	(	PUNCT
ecletica-1352	317	5	8)	8)	NUM
ecletica-1352	317	6	,	,	PUNCT
ecletica-1352	317	7	e4415	e4415	NOUN
ecletica-1352	317	8	.	.	PUNCT
ecletica-1352	318	1	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	318	2	kumar	kumar	PROPN
ecletica-1352	318	3	,	,	PUNCT
ecletica-1352	318	4	p.	p.	PROPN
ecletica-1352	318	5	;	;	PUNCT
ecletica-1352	318	6	deep	deep	ADJ
ecletica-1352	318	7	,	,	PUNCT
ecletica-1352	318	8	a.	a.	NOUN
ecletica-1352	318	9	;	;	PUNCT
ecletica-1352	318	10	kim	kim	PROPN
ecletica-1352	318	11	,	,	PUNCT
ecletica-1352	318	12	k.-h	k.-h	PROPN
ecletica-1352	318	13	.	.	PUNCT
ecletica-1352	319	1	metal	metal	NOUN
ecletica-1352	319	2	organic	organic	ADJ
ecletica-1352	319	3	frameworks	framework	NOUN
ecletica-1352	319	4	for	for	ADP
ecletica-1352	319	5	sensing	sense	VERB
ecletica-1352	319	6	applications	application	NOUN
ecletica-1352	319	7	.	.	PUNCT
ecletica-1352	320	1	trac	trac	NOUN
ecletica-1352	320	2	trends	trend	NOUN
ecletica-1352	320	3	anal	anal	PROPN
ecletica-1352	320	4	.	.	PUNCT
ecletica-1352	321	1	chem	chem	PROPN
ecletica-1352	321	2	.	.	PUNCT
ecletica-1352	322	1	2015	2015	NUM
ecletica-1352	322	2	,	,	PUNCT
ecletica-1352	322	3	73	73	NUM
ecletica-1352	322	4	,	,	PUNCT
ecletica-1352	322	5	39–53	39–53	NUM
ecletica-1352	322	6	.	.	PUNCT
ecletica-1352	323	1	https://doi.org/10.1016/j.trac.2015.04.009	https://doi.org/10.1016/j.trac.2015.04.009	NOUN
ecletica-1352	323	2	lavé	lavé	NOUN
ecletica-1352	323	3	,	,	PUNCT
ecletica-1352	323	4	t.	t.	PROPN
ecletica-1352	323	5	;	;	PUNCT
ecletica-1352	323	6	parrott	parrott	PROPN
ecletica-1352	323	7	,	,	PUNCT
ecletica-1352	323	8	n.	n.	PROPN
ecletica-1352	323	9	;	;	PUNCT
ecletica-1352	323	10	grimm	grimm	NOUN
ecletica-1352	323	11	,	,	PUNCT
ecletica-1352	323	12	h.	h.	PROPN
ecletica-1352	323	13	p.	p.	PROPN
ecletica-1352	323	14	;	;	PUNCT
ecletica-1352	323	15	fleury	fleury	PROPN
ecletica-1352	323	16	,	,	PUNCT
ecletica-1352	323	17	a.	a.	NOUN
ecletica-1352	323	18	;	;	PUNCT
ecletica-1352	323	19	reddy	reddy	PROPN
ecletica-1352	323	20	,	,	PUNCT
ecletica-1352	323	21	m.	m.	NOUN
ecletica-1352	323	22	challenges	challenge	NOUN
ecletica-1352	323	23	and	and	CCONJ
ecletica-1352	323	24	opportunities	opportunity	NOUN
ecletica-1352	323	25	with	with	ADP
ecletica-1352	323	26	modelling	modelling	NOUN
ecletica-1352	323	27	and	and	CCONJ
ecletica-1352	323	28	simulation	simulation	NOUN
ecletica-1352	323	29	in	in	ADP
ecletica-1352	323	30	drug	drug	NOUN
ecletica-1352	323	31	discovery	discovery	NOUN
ecletica-1352	323	32	and	and	CCONJ
ecletica-1352	323	33	drug	drug	NOUN
ecletica-1352	323	34	development	development	NOUN
ecletica-1352	323	35	.	.	PUNCT
ecletica-1352	324	1	xenobiotica	xenobiotica	PROPN
ecletica-1352	324	2	.	.	PUNCT
ecletica-1352	325	1	2007	2007	NUM
ecletica-1352	325	2	,	,	PUNCT
ecletica-1352	325	3	37	37	NUM
ecletica-1352	325	4	(	(	PUNCT
ecletica-1352	325	5	10–11	10–11	NUM
ecletica-1352	325	6	)	)	PUNCT
ecletica-1352	325	7	,	,	PUNCT
ecletica-1352	325	8	1295–1310	1295–1310	NUM
ecletica-1352	325	9	.	.	PUNCT
ecletica-1352	326	1	https://doi.org/10.1080/00498250701534885	https://doi.org/10.1080/00498250701534885	PROPN
ecletica-1352	326	2	lawson	lawson	PROPN
ecletica-1352	326	3	,	,	PUNCT
ecletica-1352	326	4	h.	h.	PROPN
ecletica-1352	326	5	d.	d.	PROPN
ecletica-1352	326	6	;	;	PUNCT
ecletica-1352	326	7	walton	walton	PROPN
ecletica-1352	326	8	,	,	PUNCT
ecletica-1352	326	9	s.	s.	PROPN
ecletica-1352	326	10	p.	p.	PROPN
ecletica-1352	326	11	;	;	PUNCT
ecletica-1352	326	12	chan	chan	PROPN
ecletica-1352	326	13	,	,	PUNCT
ecletica-1352	326	14	c.	c.	PROPN
ecletica-1352	326	15	metal	metal	NOUN
ecletica-1352	326	16	–	–	PUNCT
ecletica-1352	326	17	organic	organic	ADJ
ecletica-1352	326	18	frameworks	framework	NOUN
ecletica-1352	326	19	for	for	ADP
ecletica-1352	326	20	drug	drug	NOUN
ecletica-1352	326	21	delivery	delivery	NOUN
ecletica-1352	326	22	:	:	PUNCT
ecletica-1352	326	23	a	a	DET
ecletica-1352	326	24	design	design	NOUN
ecletica-1352	326	25	perspective	perspective	NOUN
ecletica-1352	326	26	.	.	PUNCT
ecletica-1352	327	1	acs	acs	PROPN
ecletica-1352	327	2	appl	appl	PROPN
ecletica-1352	327	3	.	.	PUNCT
ecletica-1352	328	1	mater	mater	PROPN
ecletica-1352	328	2	.	.	PUNCT
ecletica-1352	329	1	interfaces	interface	NOUN
ecletica-1352	329	2	.	.	PUNCT
ecletica-1352	330	1	2021	2021	NUM
ecletica-1352	330	2	,	,	PUNCT
ecletica-1352	330	3	13	13	NUM
ecletica-1352	330	4	(	(	PUNCT
ecletica-1352	330	5	6	6	NUM
ecletica-1352	330	6	)	)	PUNCT
ecletica-1352	330	7	,	,	PUNCT
ecletica-1352	330	8	7004–7020	7004–7020	NUM
ecletica-1352	330	9	.	.	PUNCT
ecletica-1352	331	1	https://doi.org/10.1021/acsami.1c01089	https://doi.org/10.1021/acsami.1c01089	ADJ
ecletica-1352	331	2	li	li	PROPN
ecletica-1352	331	3	,	,	PUNCT
ecletica-1352	331	4	h.	h.	PROPN
ecletica-1352	331	5	;	;	PUNCT
ecletica-1352	331	6	li	li	PROPN
ecletica-1352	331	7	,	,	PUNCT
ecletica-1352	331	8	l.	l.	PROPN
ecletica-1352	331	9	;	;	PUNCT
ecletica-1352	331	10	lin	lin	PROPN
ecletica-1352	331	11	,	,	PUNCT
ecletica-1352	331	12	r.-b	r.-b	NOUN
ecletica-1352	331	13	.	.	PUNCT
ecletica-1352	331	14	;	;	PUNCT
ecletica-1352	331	15	zhou	zhou	PROPN
ecletica-1352	331	16	,	,	PUNCT
ecletica-1352	331	17	w.	w.	PROPN
ecletica-1352	331	18	;	;	PUNCT
ecletica-1352	331	19	zhang	zhang	PROPN
ecletica-1352	331	20	,	,	PUNCT
ecletica-1352	331	21	z.	z.	PROPN
ecletica-1352	331	22	;	;	PUNCT
ecletica-1352	331	23	xiang	xiang	PROPN
ecletica-1352	331	24	,	,	PUNCT
ecletica-1352	331	25	s.	s.	PROPN
ecletica-1352	331	26	;	;	PUNCT
ecletica-1352	331	27	chen	chen	PROPN
ecletica-1352	331	28	,	,	PUNCT
ecletica-1352	331	29	b.	b.	PROPN
ecletica-1352	331	30	porous	porous	ADJ
ecletica-1352	331	31	metal	metal	NOUN
ecletica-1352	331	32	-	-	PUNCT
ecletica-1352	331	33	organic	organic	ADJ
ecletica-1352	331	34	frameworks	framework	NOUN
ecletica-1352	331	35	for	for	ADP
ecletica-1352	331	36	gas	gas	NOUN
ecletica-1352	331	37	storage	storage	NOUN
ecletica-1352	331	38	and	and	CCONJ
ecletica-1352	331	39	separation	separation	NOUN
ecletica-1352	331	40	:	:	PUNCT
ecletica-1352	331	41	status	status	NOUN
ecletica-1352	331	42	and	and	CCONJ
ecletica-1352	331	43	challenges	challenge	NOUN
ecletica-1352	331	44	.	.	PUNCT
ecletica-1352	332	1	energychem	energychem	PROPN
ecletica-1352	332	2	.	.	PUNCT
ecletica-1352	333	1	2019	2019	NUM
ecletica-1352	333	2	,	,	PUNCT
ecletica-1352	333	3	1	1	NUM
ecletica-1352	333	4	(	(	PUNCT
ecletica-1352	333	5	1	1	NUM
ecletica-1352	333	6	)	)	PUNCT
ecletica-1352	333	7	,	,	PUNCT
ecletica-1352	333	8	100006	100006	NUM
ecletica-1352	333	9	.	.	PUNCT
ecletica-1352	334	1	https://doi.org/10.1016/j.enchem.2019.100006	https://doi.org/10.1016/j.enchem.2019.100006	ADJ
ecletica-1352	334	2	louis	louis	PROPN
ecletica-1352	334	3	,	,	PUNCT
ecletica-1352	334	4	h.	h.	PROPN
ecletica-1352	334	5	;	;	PUNCT
ecletica-1352	334	6	gber	gber	PROPN
ecletica-1352	334	7	,	,	PUNCT
ecletica-1352	334	8	t.	t.	PROPN
ecletica-1352	334	9	e.	e.	PROPN
ecletica-1352	334	10	;	;	PUNCT
ecletica-1352	334	11	asogwa	asogwa	PROPN
ecletica-1352	334	12	,	,	PUNCT
ecletica-1352	334	13	f.	f.	PROPN
ecletica-1352	334	14	c.	c.	PROPN
ecletica-1352	334	15	;	;	PUNCT
ecletica-1352	334	16	eno	eno	PROPN
ecletica-1352	334	17	,	,	PUNCT
ecletica-1352	334	18	e.	e.	PROPN
ecletica-1352	334	19	a.	a.	PROPN
ecletica-1352	334	20	;	;	PUNCT
ecletica-1352	334	21	unimuke	unimuke	NOUN
ecletica-1352	334	22	,	,	PUNCT
ecletica-1352	334	23	t.	t.	PROPN
ecletica-1352	334	24	o.	o.	PROPN
ecletica-1352	334	25	;	;	PUNCT
ecletica-1352	334	26	bassey	bassey	NOUN
ecletica-1352	334	27	,	,	PUNCT
ecletica-1352	334	28	v.	v.	ADP
ecletica-1352	334	29	m.	m.	NOUN
ecletica-1352	334	30	;	;	PUNCT
ecletica-1352	334	31	ita	ita	PROPN
ecletica-1352	334	32	,	,	PUNCT
ecletica-1352	334	33	b.	b.	PROPN
ecletica-1352	334	34	i.	i.	PROPN
ecletica-1352	334	35	understanding	understand	VERB
ecletica-1352	334	36	the	the	DET
ecletica-1352	334	37	lithiation	lithiation	NOUN
ecletica-1352	334	38	mechanisms	mechanism	NOUN
ecletica-1352	334	39	of	of	ADP
ecletica-1352	334	40	pyrenetetrone	pyrenetetrone	NOUN
ecletica-1352	334	41	-	-	PUNCT
ecletica-1352	334	42	based	base	VERB
ecletica-1352	334	43	carbonyl	carbonyl	NOUN
ecletica-1352	334	44	compound	compound	NOUN
ecletica-1352	334	45	as	as	ADP
ecletica-1352	334	46	cathode	cathode	NOUN
ecletica-1352	334	47	material	material	NOUN
ecletica-1352	334	48	for	for	ADP
ecletica-1352	334	49	lithium	lithium	NOUN
ecletica-1352	334	50	-	-	PUNCT
ecletica-1352	334	51	ion	ion	NOUN
ecletica-1352	334	52	battery	battery	NOUN
ecletica-1352	334	53	:	:	PUNCT
ecletica-1352	334	54	insight	insight	NOUN
ecletica-1352	334	55	from	from	ADP
ecletica-1352	334	56	first	first	ADJ
ecletica-1352	334	57	principle	principle	ADJ
ecletica-1352	334	58	density	density	NOUN
ecletica-1352	334	59	functional	functional	ADJ
ecletica-1352	334	60	theory	theory	NOUN
ecletica-1352	334	61	.	.	PUNCT
ecletica-1352	335	1	mater	mater	NOUN
ecletica-1352	335	2	.	.	PUNCT
ecletica-1352	335	3	chem	chem	PROPN
ecletica-1352	335	4	.	.	PUNCT
ecletica-1352	336	1	phys	phy	NOUN
ecletica-1352	336	2	.	.	PUNCT
ecletica-1352	337	1	2022	2022	NUM
ecletica-1352	337	2	,	,	PUNCT
ecletica-1352	337	3	278	278	NUM
ecletica-1352	337	4	,	,	PUNCT
ecletica-1352	337	5	125518	125518	NUM
ecletica-1352	337	6	.	.	PUNCT
ecletica-1352	338	1	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	PROPN
ecletica-1352	338	2	mason	mason	PROPN
ecletica-1352	338	3	,	,	PUNCT
ecletica-1352	338	4	h.	h.	PROPN
ecletica-1352	338	5	e.	e.	PROPN
ecletica-1352	338	6	;	;	PUNCT
ecletica-1352	338	7	li	li	PROPN
ecletica-1352	338	8	,	,	PUNCT
ecletica-1352	338	9	w.	w.	PROPN
ecletica-1352	338	10	;	;	PUNCT
ecletica-1352	338	11	carpenter	carpenter	PROPN
ecletica-1352	338	12	,	,	PUNCT
ecletica-1352	338	13	m.	m.	NOUN
ecletica-1352	338	14	a.	a.	PROPN
ecletica-1352	338	15	;	;	PUNCT
ecletica-1352	338	16	hamilton	hamilton	PROPN
ecletica-1352	338	17	,	,	PUNCT
ecletica-1352	338	18	m.	m.	PROPN
ecletica-1352	338	19	l.	l.	PROPN
ecletica-1352	338	20	;	;	PUNCT
ecletica-1352	338	21	howard	howard	PROPN
ecletica-1352	338	22	,	,	PUNCT
ecletica-1352	338	23	j.	j.	PROPN
ecletica-1352	338	24	a.	a.	PROPN
ecletica-1352	338	25	;	;	PUNCT
ecletica-1352	338	26	sparkes	sparke	NOUN
ecletica-1352	338	27	,	,	PUNCT
ecletica-1352	338	28	h.	h.	PROPN
ecletica-1352	338	29	a.	a.	PROPN
ecletica-1352	338	30	structural	structural	ADJ
ecletica-1352	338	31	and	and	CCONJ
ecletica-1352	338	32	spectroscopic	spectroscopic	ADJ
ecletica-1352	338	33	characterisation	characterisation	NOUN
ecletica-1352	338	34	of	of	ADP
ecletica-1352	338	35	the	the	DET
ecletica-1352	338	36	spin	spin	NOUN
ecletica-1352	338	37	crossover	crossover	NOUN
ecletica-1352	338	38	in	in	ADP
ecletica-1352	338	39	[	[	X
ecletica-1352	338	40	fe(abpt)2(ncs)2	fe(abpt)2(ncs)2	NOUN
ecletica-1352	338	41	]	]	X
ecletica-1352	338	42	polymorph	polymorph	NOUN
ecletica-1352	338	43	a.	a.	NOUN
ecletica-1352	338	44	new	new	PROPN
ecletica-1352	338	45	journal	journal	NOUN
ecletica-1352	338	46	of	of	ADP
ecletica-1352	338	47	chemistry	chemistry	NOUN
ecletica-1352	338	48	.	.	PUNCT
ecletica-1352	339	1	2016	2016	NUM
ecletica-1352	339	2	,	,	PUNCT
ecletica-1352	339	3	40	40	NUM
ecletica-1352	339	4	(	(	PUNCT
ecletica-1352	339	5	3	3	NUM
ecletica-1352	339	6	)	)	PUNCT
ecletica-1352	339	7	,	,	PUNCT
ecletica-1352	339	8	2466	2466	NUM
ecletica-1352	339	9	–	–	PUNCT
ecletica-1352	339	10	2478	2478	NUM
ecletica-1352	339	11	.	.	PUNCT
ecletica-1352	340	1	https://doi.org/10.1039/c5nj02359a	https://doi.org/10.1039/c5nj02359a	NOUN
ecletica-1352	340	2	odonkor	odonkor	PROPN
ecletica-1352	340	3	,	,	PUNCT
ecletica-1352	340	4	s.	s.	PROPN
ecletica-1352	340	5	t.	t.	PROPN
ecletica-1352	340	6	;	;	PUNCT
ecletica-1352	340	7	addo	addo	PROPN
ecletica-1352	340	8	,	,	PUNCT
ecletica-1352	340	9	k.	k.	PROPN
ecletica-1352	340	10	k.	k.	PROPN
ecletica-1352	340	11	bacteria	bacteria	PROPN
ecletica-1352	340	12	resistance	resistance	NOUN
ecletica-1352	340	13	to	to	ADP
ecletica-1352	340	14	antibiotics	antibiotic	NOUN
ecletica-1352	340	15	:	:	PUNCT
ecletica-1352	340	16	recent	recent	ADJ
ecletica-1352	340	17	trends	trend	NOUN
ecletica-1352	340	18	and	and	CCONJ
ecletica-1352	340	19	challenges	challenge	NOUN
ecletica-1352	340	20	.	.	PUNCT
ecletica-1352	341	1	int	int	NOUN
ecletica-1352	341	2	.	.	PUNCT
ecletica-1352	342	1	j.	j.	PROPN
ecletica-1352	342	2	biol	biol	PROPN
ecletica-1352	342	3	.	.	PUNCT
ecletica-1352	343	1	med	med	PROPN
ecletica-1352	343	2	.	.	PUNCT
ecletica-1352	344	1	res	re	NOUN
ecletica-1352	344	2	.	.	PROPN
ecletica-1352	345	1	2011	2011	NUM
ecletica-1352	345	2	,	,	PUNCT
ecletica-1352	345	3	2	2	NUM
ecletica-1352	345	4	(	(	PUNCT
ecletica-1352	345	5	4	4	NUM
ecletica-1352	345	6	)	)	PUNCT
ecletica-1352	345	7	,	,	PUNCT
ecletica-1352	345	8	1204–1210	1204–1210	NUM
ecletica-1352	345	9	.	.	PUNCT
ecletica-1352	345	10	pastore	pastore	PROPN
ecletica-1352	345	11	,	,	PUNCT
ecletica-1352	345	12	v.	v.	PROPN
ecletica-1352	345	13	j.	j.	PROPN
ecletica-1352	345	14	;	;	PUNCT
ecletica-1352	345	15	cook	cook	VERB
ecletica-1352	345	16	,	,	PUNCT
ecletica-1352	345	17	t.	t.	PROPN
ecletica-1352	345	18	r.	r.	PROPN
ecletica-1352	345	19	;	;	PUNCT
ecletica-1352	345	20	rzayev	rzayev	PROPN
ecletica-1352	345	21	,	,	PUNCT
ecletica-1352	345	22	j.	j.	PROPN
ecletica-1352	345	23	polymer	polymer	PROPN
ecletica-1352	345	24	–	–	PUNCT
ecletica-1352	345	25	mof	mof	ADJ
ecletica-1352	345	26	hybrid	hybrid	ADJ
ecletica-1352	345	27	composites	composite	NOUN
ecletica-1352	345	28	with	with	ADP
ecletica-1352	345	29	high	high	ADJ
ecletica-1352	345	30	porosity	porosity	NOUN
ecletica-1352	345	31	and	and	CCONJ
ecletica-1352	345	32	stability	stability	NOUN
ecletica-1352	345	33	through	through	ADP
ecletica-1352	345	34	surface	surface	NOUN
ecletica-1352	345	35	-	-	PUNCT
ecletica-1352	345	36	selective	selective	ADJ
ecletica-1352	345	37	ligand	ligand	NOUN
ecletica-1352	345	38	exchange	exchange	NOUN
ecletica-1352	345	39	.	.	PUNCT
ecletica-1352	346	1	chem	chem	NOUN
ecletica-1352	346	2	.	.	PUNCT
ecletica-1352	347	1	mater	mater	NOUN
ecletica-1352	347	2	.	.	PUNCT
ecletica-1352	348	1	2018	2018	NUM
ecletica-1352	348	2	,	,	PUNCT
ecletica-1352	348	3	30	30	NUM
ecletica-1352	348	4	(	(	PUNCT
ecletica-1352	348	5	23	23	NUM
ecletica-1352	348	6	)	)	PUNCT
ecletica-1352	348	7	,	,	PUNCT
ecletica-1352	348	8	8639–8649	8639–8649	NUM
ecletica-1352	348	9	.	.	PUNCT
ecletica-1352	349	1	https://doi.org/10.1021/acs.chemmater.8b03881	https://doi.org/10.1021/acs.chemmater.8b03881	DET
ecletica-1352	349	2	purssell	purssell	NOUN
ecletica-1352	349	3	,	,	PUNCT
ecletica-1352	349	4	e.	e.	PROPN
ecletica-1352	349	5	antimicrobials	antimicrobial	NOUN
ecletica-1352	349	6	.	.	PUNCT
ecletica-1352	350	1	in	in	ADP
ecletica-1352	350	2	understanding	understand	VERB
ecletica-1352	350	3	pharmacology	pharmacology	NOUN
ecletica-1352	350	4	in	in	ADP
ecletica-1352	350	5	nursing	nursing	NOUN
ecletica-1352	350	6	practice	practice	NOUN
ecletica-1352	350	7	.	.	PUNCT
ecletica-1352	350	8	springer	springer	NOUN
ecletica-1352	350	9	,	,	PUNCT
ecletica-1352	350	10	2020	2020	NUM
ecletica-1352	350	11	;	;	PUNCT
ecletica-1352	350	12	pp	pp	ADP
ecletica-1352	350	13	147–165	147–165	NUM
ecletica-1352	350	14	.	.	PUNCT
ecletica-1352	350	15	https://doi.org/10.1007/978-3-030-32004-1_6	https://doi.org/10.1007/978-3-030-32004-1_6	X
ecletica-1352	350	16	reygaert	reygaert	PROPN
ecletica-1352	350	17	,	,	PUNCT
ecletica-1352	350	18	w.	w.	PROPN
ecletica-1352	350	19	c.	c.	PROPN
ecletica-1352	350	20	an	an	DET
ecletica-1352	350	21	overview	overview	NOUN
ecletica-1352	350	22	of	of	ADP
ecletica-1352	350	23	the	the	DET
ecletica-1352	350	24	antimicrobial	antimicrobial	ADJ
ecletica-1352	350	25	resistance	resistance	NOUN
ecletica-1352	350	26	mechanisms	mechanism	NOUN
ecletica-1352	350	27	of	of	ADP
ecletica-1352	350	28	bacteria	bacteria	NOUN
ecletica-1352	350	29	.	.	PUNCT
ecletica-1352	351	1	aims	aim	VERB
ecletica-1352	351	2	microbiol	microbiol	NOUN
ecletica-1352	351	3	.	.	PUNCT
ecletica-1352	352	1	2018	2018	NUM
ecletica-1352	352	2	,	,	PUNCT
ecletica-1352	352	3	4	4	NUM
ecletica-1352	352	4	(	(	PUNCT
ecletica-1352	352	5	3	3	NUM
ecletica-1352	352	6	)	)	PUNCT
ecletica-1352	352	7	,	,	PUNCT
ecletica-1352	352	8	482	482	NUM
ecletica-1352	352	9	–	–	PUNCT
ecletica-1352	352	10	501	501	NUM
ecletica-1352	352	11	.	.	PUNCT
ecletica-1352	353	1	https://doi.org/10.3934/microbiol.2018.3.482	https://doi.org/10.3934/microbiol.2018.3.482	NOUN
ecletica-1352	353	2	seeliger	seeliger	NOUN
ecletica-1352	353	3	,	,	PUNCT
ecletica-1352	353	4	d.	d.	PROPN
ecletica-1352	353	5	;	;	PUNCT
ecletica-1352	353	6	groot	groot	PROPN
ecletica-1352	353	7	,	,	PUNCT
ecletica-1352	353	8	b.	b.	PROPN
ecletica-1352	353	9	l.	l.	PROPN
ecletica-1352	353	10	ligand	ligand	PROPN
ecletica-1352	353	11	docking	docking	NOUN
ecletica-1352	353	12	and	and	CCONJ
ecletica-1352	353	13	binding	bind	VERB
ecletica-1352	353	14	site	site	NOUN
ecletica-1352	353	15	analysis	analysis	NOUN
ecletica-1352	353	16	with	with	ADP
ecletica-1352	353	17	pymol	pymol	NOUN
ecletica-1352	353	18	and	and	CCONJ
ecletica-1352	353	19	autodock	autodock	NOUN
ecletica-1352	353	20	/	/	SYM
ecletica-1352	353	21	vina	vina	PROPN
ecletica-1352	353	22	.	.	PUNCT
ecletica-1352	354	1	j.	j.	PROPN
ecletica-1352	354	2	comput	comput	PROPN
ecletica-1352	354	3	.	.	PUNCT
ecletica-1352	354	4	aided	aid	VERB
ecletica-1352	354	5	.	.	PUNCT
ecletica-1352	355	1	mol	mol	X
ecletica-1352	355	2	.	.	PUNCT
ecletica-1352	356	1	des	des	PROPN
ecletica-1352	356	2	.	.	PROPN
ecletica-1352	356	3	2010	2010	NUM
ecletica-1352	356	4	,	,	PUNCT
ecletica-1352	356	5	24	24	NUM
ecletica-1352	356	6	(	(	PUNCT
ecletica-1352	356	7	5	5	NUM
ecletica-1352	356	8	)	)	PUNCT
ecletica-1352	356	9	,	,	PUNCT
ecletica-1352	356	10	417–422	417–422	NUM
ecletica-1352	356	11	.	.	PUNCT
ecletica-1352	357	1	https://doi.org/10.1007/s10822-010-9352-6	https://doi.org/10.1007/s10822-010-9352-6	PROPN
ecletica-1352	357	2	sevvana	sevvana	PROPN
ecletica-1352	357	3	,	,	PUNCT
ecletica-1352	357	4	m.	m.	NOUN
ecletica-1352	357	5	;	;	PUNCT
ecletica-1352	357	6	ruf	ruf	NOUN
ecletica-1352	357	7	,	,	PUNCT
ecletica-1352	357	8	m.	m.	NOUN
ecletica-1352	357	9	;	;	PUNCT
ecletica-1352	357	10	usón	usón	NOUN
ecletica-1352	357	11	,	,	PUNCT
ecletica-1352	357	12	i.	i.	NOUN
ecletica-1352	357	13	;	;	PUNCT
ecletica-1352	357	14	sheldrick	sheldrick	NOUN
ecletica-1352	357	15	,	,	PUNCT
ecletica-1352	357	16	g.	g.	PROPN
ecletica-1352	357	17	m.	m.	PROPN
ecletica-1352	357	18	;	;	PUNCT
ecletica-1352	357	19	herbstirmer	herbstirmer	PROPN
ecletica-1352	357	20	,	,	PUNCT
ecletica-1352	357	21	r.	r.	PROPN
ecletica-1352	357	22	non	non	ADJ
ecletica-1352	357	23	-	-	ADJ
ecletica-1352	357	24	merohedral	merohedral	ADJ
ecletica-1352	357	25	twinning	twinning	NOUN
ecletica-1352	357	26	:	:	PUNCT
ecletica-1352	357	27	from	from	ADP
ecletica-1352	357	28	minerals	mineral	NOUN
ecletica-1352	357	29	to	to	ADP
ecletica-1352	357	30	proteins	protein	NOUN
ecletica-1352	357	31	.	.	PUNCT
ecletica-1352	358	1	acta	acta	PROPN
ecletica-1352	358	2	cryst	cryst	PROPN
ecletica-1352	358	3	.	.	PUNCT
ecletica-1352	359	1	2019	2019	NUM
ecletica-1352	359	2	,	,	PUNCT
ecletica-1352	359	3	d75	d75	NOUN
ecletica-1352	359	4	(	(	PUNCT
ecletica-1352	359	5	12	12	NUM
ecletica-1352	359	6	)	)	PUNCT
ecletica-1352	359	7	,	,	PUNCT
ecletica-1352	359	8	1040–1050	1040–1050	NUM
ecletica-1352	359	9	.	.	PUNCT
ecletica-1352	360	1	https://doi.org/10.1107/s2059798319010179	https://doi.org/10.1107/s2059798319010179	NUM
ecletica-1352	360	2	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	360	3	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	360	4	https://doi.org/10.1016/j.comptc.2021.113296	https://doi.org/10.1016/j.comptc.2021.113296	PROPN
ecletica-1352	360	5	https://doi.org/10.1016/j.comptc.2021.113296	https://doi.org/10.1016/j.comptc.2021.113296	PROPN
ecletica-1352	360	6	https://doi.org/10.1016/j.comptc.2021.113296	https://doi.org/10.1016/j.comptc.2021.113296	PROPN
ecletica-1352	360	7	https://doi.org/10.1016/j.comptc.2021.113296	https://doi.org/10.1016/j.comptc.2021.113296	PROPN
ecletica-1352	360	8	https://doi.org/10.1016/j.comptc.2021.113296	https://doi.org/10.1016/j.comptc.2021.113296	PROPN
ecletica-1352	360	9	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	10	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	11	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	12	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	13	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	14	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	15	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	16	https://doi.org/10.1016/j.molstruc.2022.133796	https://doi.org/10.1016/j.molstruc.2022.133796	PROPN
ecletica-1352	360	17	https://doi.org/10.1016/j.drudis.2019.10.014	https://doi.org/10.1016/j.drudis.2019.10.014	PROPN
ecletica-1352	360	18	https://doi.org/10.1016/j.drudis.2019.10.014	https://doi.org/10.1016/j.drudis.2019.10.014	PROPN
ecletica-1352	360	19	https://doi.org/10.1016/j.drudis.2019.10.014	https://doi.org/10.1016/j.drudis.2019.10.014	PROPN
ecletica-1352	360	20	https://doi.org/10.1016/j.drudis.2019.10.014	https://doi.org/10.1016/j.drudis.2019.10.014	PROPN
ecletica-1352	360	21	https://doi.org/10.1080/17460441.2020.1798926	https://doi.org/10.1080/17460441.2020.1798926	NOUN
ecletica-1352	360	22	https://doi.org/10.1080/17460441.2020.1798926	https://doi.org/10.1080/17460441.2020.1798926	NOUN
ecletica-1352	360	23	https://doi.org/10.1080/17460441.2020.1798926	https://doi.org/10.1080/17460441.2020.1798926	NOUN
ecletica-1352	360	24	https://doi.org/10.1080/17460441.2020.1798926	https://doi.org/10.1080/17460441.2020.1798926	NOUN
ecletica-1352	360	25	https://doi.org/10.1016/j.saa.2017.09.005	https://doi.org/10.1016/j.saa.2017.09.005	VERB
ecletica-1352	360	26	https://doi.org/10.1016/j.saa.2017.09.005	https://doi.org/10.1016/j.saa.2017.09.005	VERB
ecletica-1352	360	27	https://doi.org/10.1016/j.saa.2017.09.005	https://doi.org/10.1016/j.saa.2017.09.005	ADJ
ecletica-1352	360	28	https://doi.org/10.1016/j.saa.2017.09.005	https://doi.org/10.1016/j.saa.2017.09.005	ADJ
ecletica-1352	360	29	https://doi.org/10.1016/j.saa.2017.09.005	https://doi.org/10.1016/j.saa.2017.09.005	VERB
ecletica-1352	360	30	https://doi.org/10.1016/j.saa.2017.09.005	https://doi.org/10.1016/j.saa.2017.09.005	VERB
ecletica-1352	360	31	https://doi.org/10.1016/j.molstruc.2019.127633	https://doi.org/10.1016/j.molstruc.2019.127633	PROPN
ecletica-1352	360	32	https://doi.org/10.1016/j.molstruc.2019.127633	https://doi.org/10.1016/j.molstruc.2019.127633	PROPN
ecletica-1352	360	33	https://doi.org/10.1016/j.molstruc.2019.127633	https://doi.org/10.1016/j.molstruc.2019.127633	PROPN
ecletica-1352	360	34	https://doi.org/10.1016/j.molstruc.2019.127633	https://doi.org/10.1016/j.molstruc.2019.127633	PROPN
ecletica-1352	360	35	https://doi.org/10.1016/j.molstruc.2019.127633	https://doi.org/10.1016/j.molstruc.2019.127633	PROPN
ecletica-1352	360	36	https://doi.org/10.1016/j.molstruc.2019.127633	https://doi.org/10.1016/j.molstruc.2019.127633	PROPN
ecletica-1352	360	37	https://doi.org/10.1016/j.jaim.2020.05.009	https://doi.org/10.1016/j.jaim.2020.05.009	PROPN
ecletica-1352	360	38	https://doi.org/10.1016/j.jaim.2020.05.009	https://doi.org/10.1016/j.jaim.2020.05.009	PROPN
ecletica-1352	360	39	https://doi.org/10.1016/j.jaim.2020.05.009	https://doi.org/10.1016/j.jaim.2020.05.009	PROPN
ecletica-1352	360	40	https://doi.org/10.1016/j.jaim.2020.05.009	https://doi.org/10.1016/j.jaim.2020.05.009	PROPN
ecletica-1352	360	41	https://doi.org/10.1016/j.jaim.2020.05.009	https://doi.org/10.1016/j.jaim.2020.05.009	PROPN
ecletica-1352	360	42	https://doi.org/10.1016/j.jaim.2020.05.009	https://doi.org/10.1016/j.jaim.2020.05.009	PROPN
ecletica-1352	360	43	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	44	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	45	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	46	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	47	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	48	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	49	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	50	https://doi.org/10.1002/aoc.4415	https://doi.org/10.1002/aoc.4415	PROPN
ecletica-1352	360	51	https://doi.org/10.1016/j.trac.2015.04.009	https://doi.org/10.1016/j.trac.2015.04.009	NOUN
ecletica-1352	360	52	https://doi.org/10.1016/j.trac.2015.04.009	https://doi.org/10.1016/j.trac.2015.04.009	NOUN
ecletica-1352	360	53	https://doi.org/10.1016/j.trac.2015.04.009	https://doi.org/10.1016/j.trac.2015.04.009	NOUN
ecletica-1352	360	54	https://doi.org/10.1080/00498250701534885	https://doi.org/10.1080/00498250701534885	NOUN
ecletica-1352	360	55	https://doi.org/10.1080/00498250701534885	https://doi.org/10.1080/00498250701534885	NOUN
ecletica-1352	360	56	https://doi.org/10.1080/00498250701534885	https://doi.org/10.1080/00498250701534885	NOUN
ecletica-1352	360	57	https://doi.org/10.1080/00498250701534885	https://doi.org/10.1080/00498250701534885	NOUN
ecletica-1352	360	58	https://doi.org/10.1080/00498250701534885	https://doi.org/10.1080/00498250701534885	VERB
ecletica-1352	360	59	https://doi.org/10.1021/acsami.1c01089	https://doi.org/10.1021/acsami.1c01089	ADJ
ecletica-1352	360	60	https://doi.org/10.1021/acsami.1c01089	https://doi.org/10.1021/acsami.1c01089	ADJ
ecletica-1352	360	61	https://doi.org/10.1021/acsami.1c01089	https://doi.org/10.1021/acsami.1c01089	ADJ
ecletica-1352	360	62	https://doi.org/10.1021/acsami.1c01089	https://doi.org/10.1021/acsami.1c01089	ADJ
ecletica-1352	360	63	https://doi.org/10.1016/j.enchem.2019.100006	https://doi.org/10.1016/j.enchem.2019.100006	ADJ
ecletica-1352	360	64	https://doi.org/10.1016/j.enchem.2019.100006	https://doi.org/10.1016/j.enchem.2019.100006	ADJ
ecletica-1352	360	65	https://doi.org/10.1016/j.enchem.2019.100006	https://doi.org/10.1016/j.enchem.2019.100006	ADJ
ecletica-1352	360	66	https://doi.org/10.1016/j.enchem.2019.100006	https://doi.org/10.1016/j.enchem.2019.100006	ADJ
ecletica-1352	360	67	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	ADJ
ecletica-1352	360	68	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	ADJ
ecletica-1352	360	69	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	PROPN
ecletica-1352	360	70	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	PROPN
ecletica-1352	360	71	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	PROPN
ecletica-1352	360	72	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	PROPN
ecletica-1352	360	73	https://doi.org/10.1016/j.matchemphys.2021.125518	https://doi.org/10.1016/j.matchemphys.2021.125518	PROPN
ecletica-1352	360	74	https://doi.org/10.1039/c5nj02359a	https://doi.org/10.1039/c5nj02359a	PROPN
ecletica-1352	360	75	https://doi.org/10.1039/c5nj02359a	https://doi.org/10.1039/c5nj02359a	PROPN
ecletica-1352	360	76	https://doi.org/10.1039/c5nj02359a	https://doi.org/10.1039/c5nj02359a	PROPN
ecletica-1352	360	77	https://doi.org/10.1039/c5nj02359a	https://doi.org/10.1039/c5nj02359a	VERB
ecletica-1352	361	1	https://doi.org/10.1039/c5nj02359a	https://doi.org/10.1039/c5nj02359a	NOUN
ecletica-1352	362	1	https://doi.org/10.1021/acs.chemmater.8b03881	https://doi.org/10.1021/acs.chemmater.8b03881	NOUN
ecletica-1352	362	2	https://doi.org/10.1021/acs.chemmater.8b03881	https://doi.org/10.1021/acs.chemmater.8b03881	PRON
ecletica-1352	363	1	https://doi.org/10.1021/acs.chemmater.8b03881	https://doi.org/10.1021/acs.chemmater.8b03881	PRON
ecletica-1352	364	1	https://doi.org/10.1021/acs.chemmater.8b03881	https://doi.org/10.1021/acs.chemmater.8b03881	DET
ecletica-1352	364	2	https://doi.org/10.1021/acs.chemmater.8b03881	https://doi.org/10.1021/acs.chemmater.8b03881	NOUN
ecletica-1352	364	3	https://doi.org/10.1007/978-3-030-32004-1_6	https://doi.org/10.1007/978-3-030-32004-1_6	NOUN
ecletica-1352	364	4	https://doi.org/10.1007/978-3-030-32004-1_6	https://doi.org/10.1007/978-3-030-32004-1_6	NOUN
ecletica-1352	364	5	https://doi.org/10.1007/978-3-030-32004-1_6	https://doi.org/10.1007/978-3-030-32004-1_6	NOUN
ecletica-1352	364	6	https://doi.org/10.3934/microbiol.2018.3.482	https://doi.org/10.3934/microbiol.2018.3.482	PROPN
ecletica-1352	364	7	https://doi.org/10.3934/microbiol.2018.3.482	https://doi.org/10.3934/microbiol.2018.3.482	PROPN
ecletica-1352	364	8	https://doi.org/10.3934/microbiol.2018.3.482	https://doi.org/10.3934/microbiol.2018.3.482	PROPN
ecletica-1352	364	9	https://doi.org/10.1007/s10822-010-9352-6	https://doi.org/10.1007/s10822-010-9352-6	PROPN
ecletica-1352	364	10	https://doi.org/10.1007/s10822-010-9352-6	https://doi.org/10.1007/s10822-010-9352-6	NUM
ecletica-1352	364	11	https://doi.org/10.1007/s10822-010-9352-6	https://doi.org/10.1007/s10822-010-9352-6	NUM
ecletica-1352	364	12	https://doi.org/10.1007/s10822-010-9352-6	https://doi.org/10.1007/s10822-010-9352-6	NUM
ecletica-1352	365	1	https://doi.org/10.1107/s2059798319010179	https://doi.org/10.1107/s2059798319010179	NUM
ecletica-1352	365	2	https://doi.org/10.1107/s2059798319010179	https://doi.org/10.1107/s2059798319010179	NUM
ecletica-1352	365	3	https://doi.org/10.1107/s2059798319010179	https://doi.org/10.1107/s2059798319010179	PROPN
ecletica-1352	365	4	https://doi.org/10.1107/s2059798319010179	https://doi.org/10.1107/s2059798319010179	NUM
ecletica-1352	365	5	original	original	ADJ
ecletica-1352	365	6	article	article	NOUN
ecletica-1352	365	7	revista.iq.unesp.br	revista.iq.unesp.br	VERB
ecletica-1352	365	8	50	50	NUM
ecletica-1352	365	9	eclética	eclética	NOUN
ecletica-1352	365	10	química	química	PROPN
ecletica-1352	365	11	journal	journal	PROPN
ecletica-1352	365	12	,	,	PUNCT
ecletica-1352	365	13	vol	vol	NOUN
ecletica-1352	365	14	.	.	PROPN
ecletica-1352	365	15	47	47	NUM
ecletica-1352	365	16	,	,	PUNCT
ecletica-1352	365	17	n.	n.	NOUN
ecletica-1352	365	18	4	4	NUM
ecletica-1352	365	19	,	,	PUNCT
ecletica-1352	365	20	2022	2022	NUM
ecletica-1352	365	21	,	,	PUNCT
ecletica-1352	365	22	37	37	NUM
ecletica-1352	365	23	-	-	SYM
ecletica-1352	365	24	50	50	NUM
ecletica-1352	365	25	issn	issn	NOUN
ecletica-1352	365	26	:	:	PUNCT
ecletica-1352	365	27	1678	1678	NUM
ecletica-1352	365	28	-	-	SYM
ecletica-1352	365	29	4618	4618	NUM
ecletica-1352	365	30	doi	doi	NOUN
ecletica-1352	365	31	:	:	PUNCT
ecletica-1352	365	32	10.26850/1678	10.26850/1678	NUM
ecletica-1352	365	33	-	-	PUNCT
ecletica-1352	365	34	4618eqj.v47.4.2022.p37	4618eqj.v47.4.2022.p37	ADJ
ecletica-1352	365	35	-	-	PUNCT
ecletica-1352	365	36	50	50	NUM
ecletica-1352	365	37	sharbidre	sharbidre	NOUN
ecletica-1352	365	38	,	,	PUNCT
ecletica-1352	365	39	a.	a.	NOUN
ecletica-1352	365	40	;	;	PUNCT
ecletica-1352	365	41	dhage	dhage	NOUN
ecletica-1352	365	42	,	,	PUNCT
ecletica-1352	365	43	p.	p.	NOUN
ecletica-1352	365	44	;	;	PUNCT
ecletica-1352	365	45	duggal	duggal	PROPN
ecletica-1352	365	46	,	,	PUNCT
ecletica-1352	365	47	h.	h.	PROPN
ecletica-1352	365	48	;	;	PUNCT
ecletica-1352	365	49	meshram	meshram	PROPN
ecletica-1352	365	50	,	,	PUNCT
ecletica-1352	365	51	r.	r.	PROPN
ecletica-1352	365	52	in	in	ADP
ecletica-1352	365	53	silico	silico	NOUN
ecletica-1352	365	54	investigation	investigation	NOUN
ecletica-1352	365	55	of	of	ADP
ecletica-1352	365	56	tridax	tridax	NOUN
ecletica-1352	365	57	procumbens	procumbens	PROPN
ecletica-1352	365	58	phyto	phyto	ADJ
ecletica-1352	365	59	-	-	PUNCT
ecletica-1352	365	60	constituents	constituent	NOUN
ecletica-1352	365	61	against	against	ADP
ecletica-1352	365	62	sars	sar	NOUN
ecletica-1352	365	63	-	-	PUNCT
ecletica-1352	365	64	cov-2	cov-2	PART
ecletica-1352	365	65	infection	infection	NOUN
ecletica-1352	365	66	.	.	PUNCT
ecletica-1352	366	1	biointerface	biointerface	NOUN
ecletica-1352	366	2	res	re	NOUN
ecletica-1352	366	3	.	.	PUNCT
ecletica-1352	367	1	appl	appl	PROPN
ecletica-1352	367	2	.	.	PUNCT
ecletica-1352	368	1	chem	chem	PROPN
ecletica-1352	368	2	.	.	PUNCT
ecletica-1352	369	1	2021	2021	NUM
ecletica-1352	369	2	,	,	PUNCT
ecletica-1352	369	3	11	11	NUM
ecletica-1352	369	4	(	(	PUNCT
ecletica-1352	369	5	4	4	NUM
ecletica-1352	369	6	)	)	PUNCT
ecletica-1352	369	7	,	,	PUNCT
ecletica-1352	369	8	12120–12148	12120–12148	NUM
ecletica-1352	369	9	.	.	PUNCT
ecletica-1352	370	1	https://doi.org/10.33263/briac114.1212012148	https://doi.org/10.33263/briac114.1212012148	NUM
ecletica-1352	370	2	shemchuk	shemchuk	PROPN
ecletica-1352	370	3	,	,	PUNCT
ecletica-1352	370	4	o.	o.	PROPN
ecletica-1352	370	5	;	;	PUNCT
ecletica-1352	370	6	song	song	PROPN
ecletica-1352	370	7	,	,	PUNCT
ecletica-1352	370	8	l.	l.	PROPN
ecletica-1352	370	9	;	;	PUNCT
ecletica-1352	370	10	tumanov	tumanov	PROPN
ecletica-1352	370	11	,	,	PUNCT
ecletica-1352	370	12	n.	n.	NOUN
ecletica-1352	370	13	;	;	PUNCT
ecletica-1352	370	14	wouters	wouter	NOUN
ecletica-1352	370	15	,	,	PUNCT
ecletica-1352	370	16	j.	j.	PROPN
ecletica-1352	370	17	;	;	PUNCT
ecletica-1352	370	18	braga	braga	PROPN
ecletica-1352	370	19	,	,	PUNCT
ecletica-1352	370	20	d.	d.	PROPN
ecletica-1352	370	21	;	;	PUNCT
ecletica-1352	370	22	grepioni	grepioni	VERB
ecletica-1352	370	23	,	,	PUNCT
ecletica-1352	370	24	f.	f.	PROPN
ecletica-1352	370	25	;	;	PUNCT
ecletica-1352	370	26	leyssens	leyssen	NOUN
ecletica-1352	370	27	,	,	PUNCT
ecletica-1352	370	28	t.	t.	NOUN
ecletica-1352	370	29	chiral	chiral	ADJ
ecletica-1352	370	30	resolution	resolution	NOUN
ecletica-1352	370	31	of	of	ADP
ecletica-1352	370	32	rsoxiracetam	rsoxiracetam	NOUN
ecletica-1352	370	33	upon	upon	SCONJ
ecletica-1352	370	34	cocrystallization	cocrystallization	NOUN
ecletica-1352	370	35	with	with	ADP
ecletica-1352	370	36	pharmaceutically	pharmaceutically	ADV
ecletica-1352	370	37	acceptable	acceptable	ADJ
ecletica-1352	370	38	inorganic	inorganic	ADJ
ecletica-1352	370	39	salts	salt	NOUN
ecletica-1352	370	40	.	.	PUNCT
ecletica-1352	371	1	cryst	cryst	ADJ
ecletica-1352	371	2	.	.	PUNCT
ecletica-1352	372	1	growth	growth	PROPN
ecletica-1352	372	2	des	des	PROPN
ecletica-1352	372	3	.	.	PROPN
ecletica-1352	372	4	2020	2020	NUM
ecletica-1352	372	5	,	,	PUNCT
ecletica-1352	372	6	20	20	NUM
ecletica-1352	372	7	(	(	PUNCT
ecletica-1352	372	8	4	4	NUM
ecletica-1352	372	9	)	)	PUNCT
ecletica-1352	372	10	,	,	PUNCT
ecletica-1352	372	11	2602–2607	2602–2607	NUM
ecletica-1352	372	12	.	.	PUNCT
ecletica-1352	373	1	https://doi.org/10.1021/acs.cgd.9b01725	https://doi.org/10.1021/acs.cgd.9b01725	PROPN
ecletica-1352	373	2	sun	sun	NOUN
ecletica-1352	373	3	,	,	PUNCT
ecletica-1352	373	4	c.-y	c.-y	NOUN
ecletica-1352	373	5	.	.	PUNCT
ecletica-1352	373	6	;	;	PUNCT
ecletica-1352	373	7	qin	qin	PROPN
ecletica-1352	373	8	,	,	PUNCT
ecletica-1352	373	9	c.	c.	PROPN
ecletica-1352	373	10	;	;	PUNCT
ecletica-1352	373	11	wang	wang	PROPN
ecletica-1352	373	12	,	,	PUNCT
ecletica-1352	373	13	x.-l	x.-l	PROPN
ecletica-1352	373	14	.	.	PUNCT
ecletica-1352	373	15	;	;	PUNCT
ecletica-1352	373	16	su	su	PROPN
ecletica-1352	373	17	,	,	PUNCT
ecletica-1352	373	18	z.-m	z.-m	PROPN
ecletica-1352	373	19	.	.	PUNCT
ecletica-1352	374	1	metal	metal	NOUN
ecletica-1352	374	2	-	-	PUNCT
ecletica-1352	374	3	organic	organic	ADJ
ecletica-1352	374	4	frameworks	framework	NOUN
ecletica-1352	374	5	as	as	ADP
ecletica-1352	374	6	potential	potential	ADJ
ecletica-1352	374	7	drug	drug	NOUN
ecletica-1352	374	8	delivery	delivery	NOUN
ecletica-1352	374	9	systems	system	NOUN
ecletica-1352	374	10	.	.	PUNCT
ecletica-1352	375	1	expert	expert	NOUN
ecletica-1352	375	2	opin	opin	NOUN
ecletica-1352	375	3	.	.	PUNCT
ecletica-1352	376	1	drug	drug	NOUN
ecletica-1352	376	2	deliv	deliv	NOUN
ecletica-1352	376	3	.	.	PUNCT
ecletica-1352	377	1	2013	2013	NUM
ecletica-1352	377	2	,	,	PUNCT
ecletica-1352	377	3	10	10	NUM
ecletica-1352	377	4	(	(	PUNCT
ecletica-1352	377	5	1	1	NUM
ecletica-1352	377	6	)	)	PUNCT
ecletica-1352	377	7	,	,	PUNCT
ecletica-1352	378	1	89–101	89–101	PROPN
ecletica-1352	378	2	.	.	PUNCT
ecletica-1352	379	1	https://doi.org/10.1517/17425247.2013.741583	https://doi.org/10.1517/17425247.2013.741583	PROPN
ecletica-1352	379	2	takaya	takaya	PROPN
ecletica-1352	379	3	,	,	PUNCT
ecletica-1352	379	4	d.	d.	PROPN
ecletica-1352	379	5	;	;	PUNCT
ecletica-1352	379	6	niwa	niwa	PROPN
ecletica-1352	379	7	,	,	PUNCT
ecletica-1352	379	8	h.	h.	PROPN
ecletica-1352	379	9	;	;	PUNCT
ecletica-1352	379	10	mikuni	mikuni	PROPN
ecletica-1352	379	11	,	,	PUNCT
ecletica-1352	379	12	j.	j.	PROPN
ecletica-1352	379	13	;	;	PUNCT
ecletica-1352	379	14	nakamura	nakamura	PROPN
ecletica-1352	379	15	,	,	PUNCT
ecletica-1352	379	16	k.	k.	PROPN
ecletica-1352	379	17	;	;	PUNCT
ecletica-1352	379	18	handa	handa	PROPN
ecletica-1352	379	19	,	,	PUNCT
ecletica-1352	379	20	n.	n.	PROPN
ecletica-1352	379	21	;	;	PUNCT
ecletica-1352	379	22	tanaka	tanaka	PROPN
ecletica-1352	379	23	,	,	PUNCT
ecletica-1352	379	24	a.	a.	NOUN
ecletica-1352	379	25	;	;	PUNCT
ecletica-1352	379	26	yokoyama	yokoyama	PROPN
ecletica-1352	379	27	,	,	PUNCT
ecletica-1352	379	28	s.	s.	PROPN
ecletica-1352	379	29	;	;	PUNCT
ecletica-1352	379	30	honma	honma	PROPN
ecletica-1352	379	31	,	,	PUNCT
ecletica-1352	379	32	t.	t.	NOUN
ecletica-1352	379	33	protein	protein	NOUN
ecletica-1352	379	34	ligand	ligand	NOUN
ecletica-1352	379	35	interaction	interaction	NOUN
ecletica-1352	379	36	analysis	analysis	NOUN
ecletica-1352	379	37	against	against	ADP
ecletica-1352	379	38	new	new	ADJ
ecletica-1352	379	39	camkk2	camkk2	NOUN
ecletica-1352	379	40	inhibitors	inhibitor	NOUN
ecletica-1352	379	41	by	by	ADP
ecletica-1352	379	42	use	use	NOUN
ecletica-1352	379	43	of	of	ADP
ecletica-1352	379	44	x	x	NOUN
ecletica-1352	379	45	-	-	NOUN
ecletica-1352	379	46	ray	ray	NOUN
ecletica-1352	379	47	crystallography	crystallography	NOUN
ecletica-1352	379	48	and	and	CCONJ
ecletica-1352	379	49	the	the	DET
ecletica-1352	379	50	fragment	fragment	ADJ
ecletica-1352	379	51	molecular	molecular	ADJ
ecletica-1352	379	52	orbital	orbital	ADJ
ecletica-1352	379	53	(	(	PUNCT
ecletica-1352	379	54	fmo	fmo	NOUN
ecletica-1352	379	55	)	)	PUNCT
ecletica-1352	379	56	method	method	NOUN
ecletica-1352	379	57	.	.	PUNCT
ecletica-1352	380	1	j.	j.	PROPN
ecletica-1352	380	2	mol	mol	PROPN
ecletica-1352	380	3	.	.	PROPN
ecletica-1352	380	4	graph	graph	NOUN
ecletica-1352	380	5	.	.	PUNCT
ecletica-1352	381	1	2020	2020	NUM
ecletica-1352	381	2	,	,	PUNCT
ecletica-1352	381	3	99	99	NUM
ecletica-1352	381	4	,	,	PUNCT
ecletica-1352	381	5	107599	107599	NUM
ecletica-1352	381	6	.	.	PUNCT
ecletica-1352	382	1	https://doi.org/10.1016/j.jmgm.2020.107599	https://doi.org/10.1016/j.jmgm.2020.107599	PROPN
ecletica-1352	382	2	tice	tice	PROPN
ecletica-1352	382	3	,	,	PUNCT
ecletica-1352	382	4	c.	c.	PROPN
ecletica-1352	382	5	m.	m.	NOUN
ecletica-1352	382	6	selecting	select	VERB
ecletica-1352	382	7	the	the	DET
ecletica-1352	382	8	right	right	ADJ
ecletica-1352	382	9	compounds	compound	NOUN
ecletica-1352	382	10	for	for	ADP
ecletica-1352	382	11	screening	screen	VERB
ecletica-1352	382	12	:	:	PUNCT
ecletica-1352	382	13	does	do	AUX
ecletica-1352	382	14	lipinski	lipinski	PROPN
ecletica-1352	382	15	's	's	PART
ecletica-1352	382	16	rule	rule	NOUN
ecletica-1352	382	17	of	of	ADP
ecletica-1352	382	18	5	5	NUM
ecletica-1352	382	19	for	for	ADP
ecletica-1352	382	20	pharmaceuticals	pharmaceutical	NOUN
ecletica-1352	382	21	apply	apply	VERB
ecletica-1352	382	22	to	to	ADP
ecletica-1352	382	23	agrochemicals	agrochemical	NOUN
ecletica-1352	382	24	?	?	PUNCT
ecletica-1352	383	1	pest	pest	NOUN
ecletica-1352	383	2	manag	manag	NOUN
ecletica-1352	383	3	.	.	PUNCT
ecletica-1352	384	1	sci	sci	PROPN
ecletica-1352	384	2	.	.	PROPN
ecletica-1352	384	3	2001	2001	NUM
ecletica-1352	384	4	,	,	PUNCT
ecletica-1352	384	5	57	57	NUM
ecletica-1352	384	6	(	(	PUNCT
ecletica-1352	384	7	1	1	NUM
ecletica-1352	384	8	)	)	PUNCT
ecletica-1352	384	9	,	,	PUNCT
ecletica-1352	384	10	3–16	3–16	PROPN
ecletica-1352	384	11	.	.	PUNCT
ecletica-1352	385	1	https://doi.org/10.1002/1526-4998(200101)57:1<3::aidps269>3.0.co;2-6	https://doi.org/10.1002/1526-4998(200101)57:1<3::aidps269>3.0.co;2-6	PROPN
ecletica-1352	385	2	trott	trott	PROPN
ecletica-1352	385	3	,	,	PUNCT
ecletica-1352	385	4	o.	o.	PROPN
ecletica-1352	385	5	;	;	PUNCT
ecletica-1352	385	6	olson	olson	NOUN
ecletica-1352	385	7	,	,	PUNCT
ecletica-1352	385	8	a.	a.	PROPN
ecletica-1352	385	9	j.	j.	PROPN
ecletica-1352	385	10	autodock	autodock	PROPN
ecletica-1352	385	11	vina	vina	PROPN
ecletica-1352	385	12	:	:	PUNCT
ecletica-1352	385	13	improving	improve	VERB
ecletica-1352	385	14	the	the	DET
ecletica-1352	385	15	speed	speed	NOUN
ecletica-1352	385	16	and	and	CCONJ
ecletica-1352	385	17	accuracy	accuracy	NOUN
ecletica-1352	385	18	of	of	ADP
ecletica-1352	385	19	docking	docking	NOUN
ecletica-1352	385	20	with	with	ADP
ecletica-1352	385	21	a	a	DET
ecletica-1352	385	22	new	new	ADJ
ecletica-1352	385	23	scoring	scoring	NOUN
ecletica-1352	385	24	function	function	NOUN
ecletica-1352	385	25	,	,	PUNCT
ecletica-1352	385	26	efficient	efficient	ADJ
ecletica-1352	385	27	optimization	optimization	NOUN
ecletica-1352	385	28	,	,	PUNCT
ecletica-1352	385	29	and	and	CCONJ
ecletica-1352	385	30	multithreading	multithreading	NOUN
ecletica-1352	385	31	.	.	PUNCT
ecletica-1352	386	1	j.	j.	PROPN
ecletica-1352	386	2	comput	comput	PROPN
ecletica-1352	386	3	.	.	PUNCT
ecletica-1352	387	1	chem	chem	PROPN
ecletica-1352	387	2	.	.	PUNCT
ecletica-1352	388	1	2010	2010	NUM
ecletica-1352	388	2	,	,	PUNCT
ecletica-1352	388	3	31	31	NUM
ecletica-1352	388	4	(	(	PUNCT
ecletica-1352	388	5	2	2	NUM
ecletica-1352	388	6	)	)	PUNCT
ecletica-1352	388	7	,	,	PUNCT
ecletica-1352	388	8	455–461	455–461	NUM
ecletica-1352	388	9	.	.	PUNCT
ecletica-1352	389	1	https://doi.org/10.1002/jcc.21334	https://doi.org/10.1002/jcc.21334	PROPN
ecletica-1352	389	2	udoikono	udoikono	PROPN
ecletica-1352	389	3	,	,	PUNCT
ecletica-1352	389	4	a.	a.	PROPN
ecletica-1352	389	5	d.	d.	PROPN
ecletica-1352	389	6	;	;	PUNCT
ecletica-1352	389	7	louis	louis	PROPN
ecletica-1352	389	8	,	,	PUNCT
ecletica-1352	389	9	h.	h.	PROPN
ecletica-1352	389	10	;	;	PUNCT
ecletica-1352	389	11	eno	eno	PROPN
ecletica-1352	389	12	,	,	PUNCT
ecletica-1352	389	13	e.	e.	PROPN
ecletica-1352	389	14	a.	a.	PROPN
ecletica-1352	389	15	;	;	PUNCT
ecletica-1352	389	16	agwamba	agwamba	PROPN
ecletica-1352	389	17	,	,	PUNCT
ecletica-1352	389	18	e.	e.	PROPN
ecletica-1352	389	19	c.	c.	PROPN
ecletica-1352	389	20	;	;	PUNCT
ecletica-1352	389	21	unimuke	unimuke	NOUN
ecletica-1352	389	22	,	,	PUNCT
ecletica-1352	389	23	t.	t.	PROPN
ecletica-1352	389	24	o.	o.	PROPN
ecletica-1352	389	25	;	;	PUNCT
ecletica-1352	389	26	igbalagh	igbalagh	PROPN
ecletica-1352	389	27	,	,	PUNCT
ecletica-1352	389	28	a.	a.	PROPN
ecletica-1352	389	29	t.	t.	PROPN
ecletica-1352	389	30	;	;	PUNCT
ecletica-1352	389	31	odey	odey	PROPN
ecletica-1352	389	32	,	,	PUNCT
ecletica-1352	389	33	j.	j.	PROPN
ecletica-1352	389	34	o.	o.	PROPN
ecletica-1352	389	35	;	;	PUNCT
ecletica-1352	389	36	adeyinka	adeyinka	ADV
ecletica-1352	389	37	,	,	PUNCT
ecletica-1352	389	38	a.	a.	PROPN
ecletica-1352	389	39	s.	s.	PROPN
ecletica-1352	389	40	reactive	reactive	PROPN
ecletica-1352	389	41	azo	azo	PROPN
ecletica-1352	389	42	compounds	compound	NOUN
ecletica-1352	389	43	as	as	ADP
ecletica-1352	389	44	a	a	DET
ecletica-1352	389	45	potential	potential	ADJ
ecletica-1352	389	46	chemotherapy	chemotherapy	NOUN
ecletica-1352	389	47	drugs	drug	NOUN
ecletica-1352	389	48	in	in	ADP
ecletica-1352	389	49	the	the	DET
ecletica-1352	389	50	treatment	treatment	NOUN
ecletica-1352	389	51	of	of	ADP
ecletica-1352	389	52	malignant	malignant	ADJ
ecletica-1352	389	53	glioblastoma	glioblastoma	NOUN
ecletica-1352	389	54	(	(	PUNCT
ecletica-1352	389	55	gbm	gbm	NOUN
ecletica-1352	389	56	):	):	PUNCT
ecletica-1352	389	57	experimental	experimental	ADJ
ecletica-1352	389	58	and	and	CCONJ
ecletica-1352	389	59	theoretical	theoretical	ADJ
ecletica-1352	389	60	studies	study	NOUN
ecletica-1352	389	61	.	.	PUNCT
ecletica-1352	390	1	j.	j.	PROPN
ecletica-1352	390	2	photochem	photochem	PROPN
ecletica-1352	390	3	.	.	PUNCT
ecletica-1352	391	1	photobiol	photobiol	PROPN
ecletica-1352	391	2	.	.	PUNCT
ecletica-1352	392	1	2022	2022	NUM
ecletica-1352	392	2	,	,	PUNCT
ecletica-1352	392	3	10	10	NUM
ecletica-1352	392	4	,	,	PUNCT
ecletica-1352	392	5	100116	100116	NUM
ecletica-1352	392	6	.	.	PUNCT
ecletica-1352	393	1	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADJ
ecletica-1352	393	2	unimuke	unimuke	NOUN
ecletica-1352	393	3	,	,	PUNCT
ecletica-1352	393	4	t.	t.	PROPN
ecletica-1352	393	5	o.	o.	PROPN
ecletica-1352	393	6	;	;	PUNCT
ecletica-1352	393	7	louis	louis	PROPN
ecletica-1352	393	8	h.	h.	PROPN
ecletica-1352	393	9	;	;	PUNCT
ecletica-1352	393	10	eno	eno	PROPN
ecletica-1352	393	11	,	,	PUNCT
ecletica-1352	393	12	e.	e.	PROPN
ecletica-1352	393	13	a.	a.	PROPN
ecletica-1352	393	14	;	;	PUNCT
ecletica-1352	393	15	agwamba	agwamba	PROPN
ecletica-1352	393	16	,	,	PUNCT
ecletica-1352	393	17	e.	e.	PROPN
ecletica-1352	393	18	c.	c.	PROPN
ecletica-1352	393	19	;	;	PUNCT
ecletica-1352	393	20	adeyinka	adeyinka	PROPN
ecletica-1352	393	21	,	,	PUNCT
ecletica-1352	393	22	s.	s.	PROPN
ecletica-1352	393	23	a.	a.	PROPN
ecletica-1352	393	24	meta	meta	VERB
ecletica-1352	393	25	-	-	PUNCT
ecletica-1352	393	26	hybrid	hybrid	ADJ
ecletica-1352	393	27	density	density	NOUN
ecletica-1352	393	28	functional	functional	ADJ
ecletica-1352	393	29	prediction	prediction	NOUN
ecletica-1352	393	30	of	of	ADP
ecletica-1352	393	31	the	the	DET
ecletica-1352	393	32	reactivity	reactivity	NOUN
ecletica-1352	393	33	,	,	PUNCT
ecletica-1352	393	34	stability	stability	NOUN
ecletica-1352	393	35	,	,	PUNCT
ecletica-1352	393	36	and	and	CCONJ
ecletica-1352	393	37	igm	igm	NOUN
ecletica-1352	393	38	of	of	ADP
ecletica-1352	393	39	azepane	azepane	PROPN
ecletica-1352	393	40	,	,	PUNCT
ecletica-1352	393	41	oxepane	oxepane	NOUN
ecletica-1352	393	42	,	,	PUNCT
ecletica-1352	393	43	thiepane	thiepane	NOUN
ecletica-1352	393	44	,	,	PUNCT
ecletica-1352	393	45	and	and	CCONJ
ecletica-1352	393	46	halogenated	halogenated	ADJ
ecletica-1352	393	47	cycloheptane	cycloheptane	NOUN
ecletica-1352	393	48	.	.	PUNCT
ecletica-1352	394	1	acs	acs	PROPN
ecletica-1352	394	2	omega	omega	NOUN
ecletica-1352	394	3	.	.	PUNCT
ecletica-1352	395	1	2022	2022	NUM
ecletica-1352	395	2	,	,	PUNCT
ecletica-1352	395	3	7	7	NUM
ecletica-1352	395	4	(	(	PUNCT
ecletica-1352	395	5	16	16	NUM
ecletica-1352	395	6	)	)	PUNCT
ecletica-1352	395	7	,	,	PUNCT
ecletica-1352	395	8	13704−13720	13704−13720	NUM
ecletica-1352	395	9	.	.	PUNCT
ecletica-1352	396	1	https://doi.org/10.1021/acsomega.1c07361	https://doi.org/10.1021/acsomega.1c07361	PROPN
ecletica-1352	396	2	vikrant	vikrant	PROPN
ecletica-1352	396	3	,	,	PUNCT
ecletica-1352	396	4	k.	k.	PROPN
ecletica-1352	396	5	;	;	PUNCT
ecletica-1352	396	6	kumar	kumar	PROPN
ecletica-1352	396	7	,	,	PUNCT
ecletica-1352	396	8	v.	v.	PROPN
ecletica-1352	396	9	;	;	PUNCT
ecletica-1352	396	10	ok	ok	ADJ
ecletica-1352	396	11	,	,	PUNCT
ecletica-1352	396	12	y.	y.	PROPN
ecletica-1352	396	13	s.	s.	PROPN
ecletica-1352	396	14	;	;	PUNCT
ecletica-1352	397	1	kim	kim	PROPN
ecletica-1352	397	2	,	,	PUNCT
ecletica-1352	397	3	k.-h	k.-h	PROPN
ecletica-1352	397	4	.	.	PUNCT
ecletica-1352	397	5	;	;	PUNCT
ecletica-1352	397	6	deep	deep	ADJ
ecletica-1352	397	7	,	,	PUNCT
ecletica-1352	397	8	a.	a.	NOUN
ecletica-1352	397	9	metal	metal	NOUN
ecletica-1352	397	10	-	-	PUNCT
ecletica-1352	397	11	organic	organic	ADJ
ecletica-1352	397	12	framework	framework	NOUN
ecletica-1352	397	13	(	(	PUNCT
ecletica-1352	397	14	mof)-based	mof)-base	VERB
ecletica-1352	397	15	advanced	advanced	ADJ
ecletica-1352	397	16	sensing	sensing	NOUN
ecletica-1352	397	17	platforms	platform	NOUN
ecletica-1352	397	18	for	for	ADP
ecletica-1352	397	19	the	the	DET
ecletica-1352	397	20	detection	detection	NOUN
ecletica-1352	397	21	of	of	ADP
ecletica-1352	397	22	hydrogen	hydrogen	NOUN
ecletica-1352	397	23	sulfide	sulfide	NOUN
ecletica-1352	397	24	.	.	PUNCT
ecletica-1352	398	1	trac	trac	NOUN
ecletica-1352	398	2	trends	trend	NOUN
ecletica-1352	398	3	anal	anal	PROPN
ecletica-1352	398	4	.	.	PUNCT
ecletica-1352	399	1	chem	chem	PROPN
ecletica-1352	399	2	.	.	PUNCT
ecletica-1352	400	1	2018	2018	NUM
ecletica-1352	400	2	,	,	PUNCT
ecletica-1352	400	3	105	105	NUM
ecletica-1352	400	4	,	,	PUNCT
ecletica-1352	400	5	263–281	263–281	NUM
ecletica-1352	400	6	.	.	PUNCT
ecletica-1352	401	1	https://doi.org/10.1016/j.trac.2018.05.013	https://doi.org/10.1016/j.trac.2018.05.013	PROPN
ecletica-1352	401	2	wu	wu	PROPN
ecletica-1352	401	3	,	,	PUNCT
ecletica-1352	401	4	j.	j.	PROPN
ecletica-1352	401	5	c.	c.	PROPN
ecletica-1352	401	6	;	;	PUNCT
ecletica-1352	401	7	chattree	chattree	PROPN
ecletica-1352	401	8	,	,	PUNCT
ecletica-1352	401	9	g.	g.	PROPN
ecletica-1352	401	10	;	;	PUNCT
ecletica-1352	401	11	ren	ren	PROPN
ecletica-1352	401	12	,	,	PUNCT
ecletica-1352	401	13	p.	p.	NOUN
ecletica-1352	401	14	automation	automation	NOUN
ecletica-1352	401	15	of	of	ADP
ecletica-1352	401	16	amoeba	amoeba	NOUN
ecletica-1352	401	17	polarizable	polarizable	ADJ
ecletica-1352	401	18	force	force	NOUN
ecletica-1352	401	19	field	field	NOUN
ecletica-1352	401	20	parameterization	parameterization	NOUN
ecletica-1352	401	21	for	for	ADP
ecletica-1352	401	22	small	small	ADJ
ecletica-1352	401	23	molecules	molecule	NOUN
ecletica-1352	401	24	.	.	PUNCT
ecletica-1352	402	1	theor	theor	PROPN
ecletica-1352	402	2	.	.	PUNCT
ecletica-1352	402	3	chem	chem	PROPN
ecletica-1352	402	4	.	.	PUNCT
ecletica-1352	403	1	acc	acc	PROPN
ecletica-1352	403	2	.	.	PROPN
ecletica-1352	403	3	2012	2012	NUM
ecletica-1352	403	4	,	,	PUNCT
ecletica-1352	403	5	131	131	NUM
ecletica-1352	403	6	(	(	PUNCT
ecletica-1352	403	7	3	3	NUM
ecletica-1352	403	8	)	)	PUNCT
ecletica-1352	403	9	,	,	PUNCT
ecletica-1352	403	10	1138	1138	NUM
ecletica-1352	403	11	.	.	PUNCT
ecletica-1352	404	1	https://doi.org/10.1007/s00214-012-1138-6	https://doi.org/10.1007/s00214-012-1138-6	NUM
ecletica-1352	404	2	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1352	404	3	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p37-50	PROPN
ecletica-1352	404	4	https://doi.org/10.33263/briac114.1212012148	https://doi.org/10.33263/briac114.1212012148	NUM
ecletica-1352	404	5	https://doi.org/10.33263/briac114.1212012148	https://doi.org/10.33263/briac114.1212012148	NUM
ecletica-1352	404	6	https://doi.org/10.33263/briac114.1212012148	https://doi.org/10.33263/briac114.1212012148	NUM
ecletica-1352	404	7	https://doi.org/10.33263/briac114.1212012148	https://doi.org/10.33263/briac114.1212012148	NUM
ecletica-1352	404	8	https://doi.org/10.33263/briac114.1212012148	https://doi.org/10.33263/briac114.1212012148	NUM
ecletica-1352	404	9	https://doi.org/10.1021/acs.cgd.9b01725	https://doi.org/10.1021/acs.cgd.9b01725	PROPN
ecletica-1352	404	10	https://doi.org/10.1021/acs.cgd.9b01725	https://doi.org/10.1021/acs.cgd.9b01725	NUM
ecletica-1352	404	11	https://doi.org/10.1021/acs.cgd.9b01725	https://doi.org/10.1021/acs.cgd.9b01725	ADJ
ecletica-1352	404	12	https://doi.org/10.1021/acs.cgd.9b01725	https://doi.org/10.1021/acs.cgd.9b01725	ADJ
ecletica-1352	404	13	https://doi.org/10.1021/acs.cgd.9b01725	https://doi.org/10.1021/acs.cgd.9b01725	ADJ
ecletica-1352	404	14	https://doi.org/10.1517/17425247.2013.741583	https://doi.org/10.1517/17425247.2013.741583	NOUN
ecletica-1352	404	15	https://doi.org/10.1517/17425247.2013.741583	https://doi.org/10.1517/17425247.2013.741583	NOUN
ecletica-1352	404	16	https://doi.org/10.1517/17425247.2013.741583	https://doi.org/10.1517/17425247.2013.741583	PUNCT
ecletica-1352	404	17	https://doi.org/10.1517/17425247.2013.741583	https://doi.org/10.1517/17425247.2013.741583	PUNCT
ecletica-1352	405	1	https://doi.org/10.1016/j.jmgm.2020.107599	https://doi.org/10.1016/j.jmgm.2020.107599	PROPN
ecletica-1352	405	2	https://doi.org/10.1016/j.jmgm.2020.107599	https://doi.org/10.1016/j.jmgm.2020.107599	PROPN
ecletica-1352	405	3	https://doi.org/10.1016/j.jmgm.2020.107599	https://doi.org/10.1016/j.jmgm.2020.107599	PROPN
ecletica-1352	405	4	https://doi.org/10.1016/j.jmgm.2020.107599	https://doi.org/10.1016/j.jmgm.2020.107599	PROPN
ecletica-1352	405	5	https://doi.org/10.1016/j.jmgm.2020.107599	https://doi.org/10.1016/j.jmgm.2020.107599	PROPN
ecletica-1352	405	6	https://doi.org/10.1016/j.jmgm.2020.107599	https://doi.org/10.1016/j.jmgm.2020.107599	PROPN
ecletica-1352	405	7	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	PROPN
ecletica-1352	405	8	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	PROPN
ecletica-1352	405	9	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	PROPN
ecletica-1352	405	10	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	PROPN
ecletica-1352	405	11	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	https://doi.org/10.1002/1526-4998(200101)57:1%3c3::aid-ps269%3e3.0.co;2-6	NOUN
ecletica-1352	406	1	https://doi.org/10.1002/jcc.21334	https://doi.org/10.1002/jcc.21334	PROPN
ecletica-1352	406	2	https://doi.org/10.1002/jcc.21334	https://doi.org/10.1002/jcc.21334	PROPN
ecletica-1352	406	3	https://doi.org/10.1002/jcc.21334	https://doi.org/10.1002/jcc.21334	PROPN
ecletica-1352	406	4	https://doi.org/10.1002/jcc.21334	https://doi.org/10.1002/jcc.21334	PROPN
ecletica-1352	406	5	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADV
ecletica-1352	406	6	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADV
ecletica-1352	406	7	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADV
ecletica-1352	406	8	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADV
ecletica-1352	406	9	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADV
ecletica-1352	406	10	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADJ
ecletica-1352	406	11	https://doi.org/10.1016/j.jpap.2022.100116	https://doi.org/10.1016/j.jpap.2022.100116	ADJ
ecletica-1352	406	12	https://doi.org/10.1021/acsomega.1c07361	https://doi.org/10.1021/acsomega.1c07361	NOUN
ecletica-1352	406	13	https://doi.org/10.1021/acsomega.1c07361	https://doi.org/10.1021/acsomega.1c07361	VERB
ecletica-1352	406	14	https://doi.org/10.1021/acsomega.1c07361	https://doi.org/10.1021/acsomega.1c07361	VERB
ecletica-1352	406	15	https://doi.org/10.1021/acsomega.1c07361	https://doi.org/10.1021/acsomega.1c07361	VERB
ecletica-1352	406	16	https://doi.org/10.1021/acsomega.1c07361	https://doi.org/10.1021/acsomega.1c07361	NOUN
ecletica-1352	406	17	https://doi.org/10.1021/acsomega.1c07361	https://doi.org/10.1021/acsomega.1c07361	VERB
ecletica-1352	406	18	https://doi.org/10.1016/j.trac.2018.05.013	https://doi.org/10.1016/j.trac.2018.05.013	PROPN
ecletica-1352	406	19	https://doi.org/10.1016/j.trac.2018.05.013	https://doi.org/10.1016/j.trac.2018.05.013	PROPN
ecletica-1352	406	20	https://doi.org/10.1016/j.trac.2018.05.013	https://doi.org/10.1016/j.trac.2018.05.013	PROPN
ecletica-1352	406	21	https://doi.org/10.1016/j.trac.2018.05.013	https://doi.org/10.1016/j.trac.2018.05.013	PROPN
ecletica-1352	406	22	https://doi.org/10.1016/j.trac.2018.05.013	https://doi.org/10.1016/j.trac.2018.05.013	PROPN
ecletica-1352	406	23	https://doi.org/10.1007/s00214-012-1138-6	https://doi.org/10.1007/s00214-012-1138-6	X
ecletica-1352	406	24	https://doi.org/10.1007/s00214-012-1138-6	https://doi.org/10.1007/s00214-012-1138-6	NUM
ecletica-1352	406	25	https://doi.org/10.1007/s00214-012-1138-6	https://doi.org/10.1007/s00214-012-1138-6	NUM
ecletica-1352	406	26	https://doi.org/10.1007/s00214-012-1138-6	https://doi.org/10.1007/s00214-012-1138-6	NUM