id	sid	tid	token	lemma	pos
ajst-32394	1	1	202	202	NUM
ajst-32394	1	2	application	application	NOUN
ajst-32394	1	3	and	and	CCONJ
ajst-32394	1	4	research	research	NOUN
ajst-32394	1	5	progress	progress	NOUN
ajst-32394	1	6	of	of	ADP
ajst-32394	1	7	machine	machine	NOUN
ajst-32394	1	8	learning	learn	VERB
ajst-32394	1	9	in	in	ADP
ajst-32394	1	10	network	network	NOUN
ajst-32394	1	11	toxicology	toxicology	NOUN
ajst-32394	1	12	tongjia	tongjia	ADP
ajst-32394	1	13	luo	luo	PROPN
ajst-32394	1	14	*	*	PUNCT
ajst-32394	1	15	school	school	NOUN
ajst-32394	1	16	of	of	ADP
ajst-32394	1	17	electrical	electrical	ADJ
ajst-32394	1	18	engineering	engineering	NOUN
ajst-32394	1	19	,	,	PUNCT
ajst-32394	1	20	computing	computing	NOUN
ajst-32394	1	21	and	and	CCONJ
ajst-32394	1	22	mathematical	mathematical	ADJ
ajst-32394	1	23	sciences	sciences	PROPN
ajst-32394	1	24	,	,	PUNCT
ajst-32394	1	25	curtin	curtin	PROPN
ajst-32394	1	26	university	university	PROPN
ajst-32394	1	27	,	,	PUNCT
ajst-32394	1	28	curtin	curtin	PROPN
ajst-32394	1	29	singapore	singapore	PROPN
ajst-32394	1	30	,	,	PUNCT
ajst-32394	1	31	117684	117684	NUM
ajst-32394	1	32	,	,	PUNCT
ajst-32394	1	33	singapore	singapore	PROPN
ajst-32394	1	34	*	*	PUNCT
ajst-32394	1	35	corresponding	correspond	VERB
ajst-32394	1	36	author	author	NOUN
ajst-32394	1	37	email	email	NOUN
ajst-32394	1	38	:	:	PUNCT
ajst-32394	1	39	21571435@student.curtin.edu.au	21571435@student.curtin.edu.au	NUM
ajst-32394	1	40	abstract	abstract	ADJ
ajst-32394	1	41	.	.	PUNCT
ajst-32394	2	1	machine	machine	NOUN
ajst-32394	2	2	learning	learning	NOUN
ajst-32394	2	3	(	(	PUNCT
ajst-32394	2	4	ml	ml	NOUN
ajst-32394	2	5	)	)	PUNCT
ajst-32394	2	6	has	have	AUX
ajst-32394	2	7	profoundly	profoundly	ADV
ajst-32394	2	8	advanced	advanced	ADJ
ajst-32394	2	9	and	and	CCONJ
ajst-32394	2	10	found	find	VERB
ajst-32394	2	11	extensive	extensive	ADJ
ajst-32394	2	12	applications	application	NOUN
ajst-32394	2	13	in	in	ADP
ajst-32394	2	14	network	network	NOUN
ajst-32394	2	15	toxicology	toxicology	NOUN
ajst-32394	2	16	,	,	PUNCT
ajst-32394	2	17	significantly	significantly	ADV
ajst-32394	2	18	enhancing	enhance	VERB
ajst-32394	2	19	the	the	DET
ajst-32394	2	20	prediction	prediction	NOUN
ajst-32394	2	21	and	and	CCONJ
ajst-32394	2	22	assessment	assessment	NOUN
ajst-32394	2	23	of	of	ADP
ajst-32394	2	24	toxicity	toxicity	NOUN
ajst-32394	2	25	through	through	ADP
ajst-32394	2	26	datadriven	datadriven	ADJ
ajst-32394	2	27	methodologies	methodology	NOUN
ajst-32394	2	28	.	.	PUNCT
ajst-32394	3	1	this	this	DET
ajst-32394	3	2	review	review	NOUN
ajst-32394	3	3	examines	examine	VERB
ajst-32394	3	4	the	the	DET
ajst-32394	3	5	integration	integration	NOUN
ajst-32394	3	6	of	of	ADP
ajst-32394	3	7	machine	machine	NOUN
ajst-32394	3	8	learning	learn	VERB
ajst-32394	3	9	within	within	ADP
ajst-32394	3	10	network	network	NOUN
ajst-32394	3	11	toxicology	toxicology	NOUN
ajst-32394	3	12	,	,	PUNCT
ajst-32394	3	13	addressing	address	VERB
ajst-32394	3	14	fundamental	fundamental	ADJ
ajst-32394	3	15	concepts	concept	NOUN
ajst-32394	3	16	,	,	PUNCT
ajst-32394	3	17	the	the	DET
ajst-32394	3	18	exploration	exploration	NOUN
ajst-32394	3	19	of	of	ADP
ajst-32394	3	20	pathological	pathological	ADJ
ajst-32394	3	21	mechanisms	mechanism	NOUN
ajst-32394	3	22	,	,	PUNCT
ajst-32394	3	23	the	the	DET
ajst-32394	3	24	enhancement	enhancement	NOUN
ajst-32394	3	25	of	of	ADP
ajst-32394	3	26	diagnostic	diagnostic	ADJ
ajst-32394	3	27	techniques	technique	NOUN
ajst-32394	3	28	,	,	PUNCT
ajst-32394	3	29	the	the	DET
ajst-32394	3	30	development	development	NOUN
ajst-32394	3	31	of	of	ADP
ajst-32394	3	32	therapeutic	therapeutic	ADJ
ajst-32394	3	33	strategies	strategy	NOUN
ajst-32394	3	34	,	,	PUNCT
ajst-32394	3	35	as	as	ADV
ajst-32394	3	36	well	well	ADV
ajst-32394	3	37	as	as	ADP
ajst-32394	3	38	the	the	DET
ajst-32394	3	39	associated	associated	ADJ
ajst-32394	3	40	controversies	controversy	NOUN
ajst-32394	3	41	,	,	PUNCT
ajst-32394	3	42	challenges	challenge	NOUN
ajst-32394	3	43	,	,	PUNCT
ajst-32394	3	44	and	and	CCONJ
ajst-32394	3	45	future	future	ADJ
ajst-32394	3	46	directions	direction	NOUN
ajst-32394	3	47	.	.	PUNCT
ajst-32394	4	1	by	by	ADP
ajst-32394	4	2	synthesizing	synthesize	VERB
ajst-32394	4	3	information	information	NOUN
ajst-32394	4	4	from	from	ADP
ajst-32394	4	5	a	a	DET
ajst-32394	4	6	diverse	diverse	ADJ
ajst-32394	4	7	array	array	NOUN
ajst-32394	4	8	of	of	ADP
ajst-32394	4	9	sources	source	NOUN
ajst-32394	4	10	,	,	PUNCT
ajst-32394	4	11	the	the	DET
ajst-32394	4	12	review	review	NOUN
ajst-32394	4	13	elaborates	elaborate	VERB
ajst-32394	4	14	on	on	ADP
ajst-32394	4	15	the	the	DET
ajst-32394	4	16	evolution	evolution	NOUN
ajst-32394	4	17	of	of	ADP
ajst-32394	4	18	machine	machine	NOUN
ajst-32394	4	19	learning	learn	VERB
ajst-32394	4	20	algorithms	algorithm	NOUN
ajst-32394	4	21	in	in	ADP
ajst-32394	4	22	toxicology	toxicology	NOUN
ajst-32394	4	23	,	,	PUNCT
ajst-32394	4	24	the	the	DET
ajst-32394	4	25	construction	construction	NOUN
ajst-32394	4	26	of	of	ADP
ajst-32394	4	27	pertinent	pertinent	ADJ
ajst-32394	4	28	databases	database	NOUN
ajst-32394	4	29	,	,	PUNCT
ajst-32394	4	30	and	and	CCONJ
ajst-32394	4	31	their	their	PRON
ajst-32394	4	32	applications	application	NOUN
ajst-32394	4	33	across	across	ADP
ajst-32394	4	34	various	various	ADJ
ajst-32394	4	35	facets	facet	NOUN
ajst-32394	4	36	of	of	ADP
ajst-32394	4	37	toxicological	toxicological	ADJ
ajst-32394	4	38	research	research	NOUN
ajst-32394	4	39	.	.	PUNCT
ajst-32394	5	1	additionally	additionally	ADV
ajst-32394	5	2	,	,	PUNCT
ajst-32394	5	3	the	the	DET
ajst-32394	5	4	review	review	NOUN
ajst-32394	5	5	explores	explore	VERB
ajst-32394	5	6	the	the	DET
ajst-32394	5	7	ethical	ethical	ADJ
ajst-32394	5	8	,	,	PUNCT
ajst-32394	5	9	interpretability	interpretability	NOUN
ajst-32394	5	10	,	,	PUNCT
ajst-32394	5	11	and	and	CCONJ
ajst-32394	5	12	regulatory	regulatory	ADJ
ajst-32394	5	13	issues	issue	NOUN
ajst-32394	5	14	linked	link	VERB
ajst-32394	5	15	to	to	ADP
ajst-32394	5	16	these	these	DET
ajst-32394	5	17	applications	application	NOUN
ajst-32394	5	18	,	,	PUNCT
ajst-32394	5	19	while	while	SCONJ
ajst-32394	5	20	highlighting	highlight	VERB
ajst-32394	5	21	emerging	emerge	VERB
ajst-32394	5	22	trends	trend	NOUN
ajst-32394	5	23	and	and	CCONJ
ajst-32394	5	24	the	the	DET
ajst-32394	5	25	potential	potential	NOUN
ajst-32394	5	26	of	of	ADP
ajst-32394	5	27	machine	machine	NOUN
ajst-32394	5	28	learning	learning	NOUN
ajst-32394	5	29	in	in	ADP
ajst-32394	5	30	predictive	predictive	ADJ
ajst-32394	5	31	toxicology	toxicology	NOUN
ajst-32394	5	32	and	and	CCONJ
ajst-32394	5	33	future	future	ADJ
ajst-32394	5	34	toxicological	toxicological	ADJ
ajst-32394	5	35	investigations	investigation	NOUN
ajst-32394	5	36	.	.	PUNCT
ajst-32394	6	1	keywords	keyword	NOUN
ajst-32394	6	2	:	:	PUNCT
ajst-32394	6	3	machine	machine	NOUN
ajst-32394	6	4	learning	learning	NOUN
ajst-32394	6	5	,	,	PUNCT
ajst-32394	6	6	network	network	NOUN
ajst-32394	6	7	toxicology	toxicology	NOUN
ajst-32394	6	8	,	,	PUNCT
ajst-32394	6	9	research	research	NOUN
ajst-32394	6	10	progress	progress	NOUN
ajst-32394	6	11	.	.	PUNCT
ajst-32394	7	1	1	1	X
ajst-32394	7	2	.	.	X
ajst-32394	7	3	introduction	introduction	NOUN
ajst-32394	7	4	network	network	NOUN
ajst-32394	7	5	toxicology	toxicology	NOUN
ajst-32394	7	6	integrates	integrate	NOUN
ajst-32394	7	7	computational	computational	ADJ
ajst-32394	7	8	and	and	CCONJ
ajst-32394	7	9	biological	biological	ADJ
ajst-32394	7	10	networks	network	NOUN
ajst-32394	7	11	to	to	PART
ajst-32394	7	12	study	study	VERB
ajst-32394	7	13	chemicalbiological	chemicalbiological	ADJ
ajst-32394	7	14	interactions	interaction	NOUN
ajst-32394	7	15	,	,	PUNCT
ajst-32394	7	16	aiming	aim	VERB
ajst-32394	7	17	to	to	PART
ajst-32394	7	18	predict	predict	VERB
ajst-32394	7	19	and	and	CCONJ
ajst-32394	7	20	mitigate	mitigate	VERB
ajst-32394	7	21	toxic	toxic	ADJ
ajst-32394	7	22	effects	effect	NOUN
ajst-32394	7	23	[	[	X
ajst-32394	7	24	1	1	NUM
ajst-32394	7	25	]	]	PUNCT
ajst-32394	7	26	.	.	PUNCT
ajst-32394	8	1	the	the	DET
ajst-32394	8	2	rise	rise	NOUN
ajst-32394	8	3	of	of	ADP
ajst-32394	8	4	machine	machine	NOUN
ajst-32394	8	5	learning	learning	NOUN
ajst-32394	8	6	(	(	PUNCT
ajst-32394	8	7	ml	ml	NOUN
ajst-32394	8	8	)	)	PUNCT
ajst-32394	8	9	has	have	AUX
ajst-32394	8	10	transformed	transform	VERB
ajst-32394	8	11	this	this	DET
ajst-32394	8	12	field	field	NOUN
ajst-32394	8	13	by	by	ADP
ajst-32394	8	14	enabling	enable	VERB
ajst-32394	8	15	the	the	DET
ajst-32394	8	16	analysis	analysis	NOUN
ajst-32394	8	17	of	of	ADP
ajst-32394	8	18	vast	vast	ADJ
ajst-32394	8	19	,	,	PUNCT
ajst-32394	8	20	complex	complex	ADJ
ajst-32394	8	21	datasets	dataset	NOUN
ajst-32394	8	22	—	—	PUNCT
ajst-32394	8	23	genomics	genomics	NOUN
ajst-32394	8	24	,	,	PUNCT
ajst-32394	8	25	proteomics	proteomic	NOUN
ajst-32394	8	26	,	,	PUNCT
ajst-32394	8	27	imaging	imaging	NOUN
ajst-32394	8	28	—	—	PUNCT
ajst-32394	8	29	that	that	SCONJ
ajst-32394	8	30	traditional	traditional	ADJ
ajst-32394	8	31	methods	method	NOUN
ajst-32394	8	32	struggle	struggle	VERB
ajst-32394	8	33	to	to	PART
ajst-32394	8	34	handle	handle	VERB
ajst-32394	8	35	[	[	X
ajst-32394	8	36	2	2	NUM
ajst-32394	8	37	]	]	PUNCT
ajst-32394	8	38	.	.	PUNCT
ajst-32394	9	1	unlike	unlike	ADP
ajst-32394	9	2	conventional	conventional	ADJ
ajst-32394	9	3	animalbased	animalbase	VERB
ajst-32394	9	4	assays	assay	NOUN
ajst-32394	9	5	,	,	PUNCT
ajst-32394	9	6	which	which	PRON
ajst-32394	9	7	face	face	VERB
ajst-32394	9	8	ethical	ethical	ADJ
ajst-32394	9	9	,	,	PUNCT
ajst-32394	9	10	cost	cost	NOUN
ajst-32394	9	11	,	,	PUNCT
ajst-32394	9	12	and	and	CCONJ
ajst-32394	9	13	scalability	scalability	NOUN
ajst-32394	9	14	issues	issue	NOUN
ajst-32394	9	15	,	,	PUNCT
ajst-32394	9	16	ml	ml	AUX
ajst-32394	9	17	offers	offer	VERB
ajst-32394	9	18	automated	automate	VERB
ajst-32394	9	19	,	,	PUNCT
ajst-32394	9	20	data	data	NOUN
ajst-32394	9	21	-	-	PUNCT
ajst-32394	9	22	driven	drive	VERB
ajst-32394	9	23	solutions	solution	NOUN
ajst-32394	9	24	,	,	PUNCT
ajst-32394	9	25	aligning	align	VERB
ajst-32394	9	26	with	with	ADP
ajst-32394	9	27	oecd	oecd	PROPN
ajst-32394	9	28	/	/	SYM
ajst-32394	9	29	reach	reach	NOUN
ajst-32394	9	30	guidelines	guideline	NOUN
ajst-32394	9	31	for	for	ADP
ajst-32394	9	32	safer	safe	ADJ
ajst-32394	9	33	chemical	chemical	NOUN
ajst-32394	9	34	assessments	assessment	NOUN
ajst-32394	9	35	[	[	X
ajst-32394	9	36	3	3	NUM
ajst-32394	9	37	]	]	PUNCT
ajst-32394	9	38	.	.	PUNCT
ajst-32394	10	1	machine	machine	NOUN
ajst-32394	10	2	learning	learn	VERB
ajst-32394	10	3	algorithms	algorithm	NOUN
ajst-32394	10	4	have	have	AUX
ajst-32394	10	5	witnessed	witness	VERB
ajst-32394	10	6	a	a	DET
ajst-32394	10	7	remarkable	remarkable	ADJ
ajst-32394	10	8	evolution	evolution	NOUN
ajst-32394	10	9	in	in	ADP
ajst-32394	10	10	the	the	DET
ajst-32394	10	11	field	field	NOUN
ajst-32394	10	12	of	of	ADP
ajst-32394	10	13	toxicology	toxicology	NOUN
ajst-32394	10	14	,	,	PUNCT
ajst-32394	10	15	revolutionizing	revolutionize	VERB
ajst-32394	10	16	the	the	DET
ajst-32394	10	17	way	way	NOUN
ajst-32394	10	18	toxicity	toxicity	NOUN
ajst-32394	10	19	assessment	assessment	NOUN
ajst-32394	10	20	and	and	CCONJ
ajst-32394	10	21	prediction	prediction	NOUN
ajst-32394	10	22	are	be	AUX
ajst-32394	10	23	conducted	conduct	VERB
ajst-32394	10	24	.	.	PUNCT
ajst-32394	11	1	in	in	ADP
ajst-32394	11	2	the	the	DET
ajst-32394	11	3	past	past	ADJ
ajst-32394	11	4	decade	decade	NOUN
ajst-32394	11	5	,	,	PUNCT
ajst-32394	11	6	hundreds	hundred	NOUN
ajst-32394	11	7	of	of	ADP
ajst-32394	11	8	absorption	absorption	NOUN
ajst-32394	11	9	,	,	PUNCT
ajst-32394	11	10	distribution	distribution	NOUN
ajst-32394	11	11	,	,	PUNCT
ajst-32394	11	12	metabolism	metabolism	NOUN
ajst-32394	11	13	,	,	PUNCT
ajst-32394	11	14	excretion	excretion	NOUN
ajst-32394	11	15	,	,	PUNCT
ajst-32394	11	16	and	and	CCONJ
ajst-32394	11	17	toxicity	toxicity	NOUN
ajst-32394	11	18	(	(	PUNCT
ajst-32394	11	19	adme	adme	PROPN
ajst-32394	11	20	/	/	SYM
ajst-32394	11	21	tox	tox	NOUN
ajst-32394	11	22	)	)	PUNCT
ajst-32394	11	23	models	model	NOUN
ajst-32394	11	24	have	have	AUX
ajst-32394	11	25	been	be	AUX
ajst-32394	11	26	developed	develop	VERB
ajst-32394	11	27	,	,	PUNCT
ajst-32394	11	28	yet	yet	CCONJ
ajst-32394	11	29	many	many	ADJ
ajst-32394	11	30	were	be	AUX
ajst-32394	11	31	inaccessible	inaccessible	ADJ
ajst-32394	11	32	to	to	ADP
ajst-32394	11	33	the	the	DET
ajst-32394	11	34	wider	wide	ADJ
ajst-32394	11	35	scientific	scientific	ADJ
ajst-32394	11	36	community	community	NOUN
ajst-32394	11	37	.	.	PUNCT
ajst-32394	12	1	to	to	PART
ajst-32394	12	2	address	address	VERB
ajst-32394	12	3	this	this	PRON
ajst-32394	12	4	,	,	PUNCT
ajst-32394	12	5	open	open	ADJ
ajst-32394	12	6	source	source	NOUN
ajst-32394	12	7	bayesian	bayesian	NOUN
ajst-32394	12	8	models	model	NOUN
ajst-32394	12	9	have	have	AUX
ajst-32394	12	10	been	be	AUX
ajst-32394	12	11	introduced	introduce	VERB
ajst-32394	12	12	,	,	PUNCT
ajst-32394	12	13	enabling	enable	VERB
ajst-32394	12	14	the	the	DET
ajst-32394	12	15	creation	creation	NOUN
ajst-32394	12	16	of	of	ADP
ajst-32394	12	17	a	a	DET
ajst-32394	12	18	reference	reference	NOUN
ajst-32394	12	19	implementation	implementation	NOUN
ajst-32394	12	20	within	within	ADP
ajst-32394	12	21	the	the	DET
ajst-32394	12	22	chemistry	chemistry	NOUN
ajst-32394	12	23	development	development	NOUN
ajst-32394	12	24	kit	kit	NOUN
ajst-32394	12	25	(	(	PUNCT
ajst-32394	12	26	cdk	cdk	PROPN
ajst-32394	12	27	)	)	PUNCT
ajst-32394	12	28	project	project	NOUN
ajst-32394	12	29	.	.	PUNCT
ajst-32394	13	1	these	these	DET
ajst-32394	13	2	models	model	NOUN
ajst-32394	13	3	,	,	PUNCT
ajst-32394	13	4	when	when	SCONJ
ajst-32394	13	5	combined	combine	VERB
ajst-32394	13	6	with	with	ADP
ajst-32394	13	7	fcfp6	fcfp6	NOUN
ajst-32394	13	8	descriptors	descriptor	NOUN
ajst-32394	13	9	in	in	ADP
ajst-32394	13	10	the	the	DET
ajst-32394	13	11	cdd	cdd	PROPN
ajst-32394	13	12	vault	vault	NOUN
ajst-32394	13	13	,	,	PUNCT
ajst-32394	13	14	can	can	AUX
ajst-32394	13	15	rapidly	rapidly	ADV
ajst-32394	13	16	generate	generate	VERB
ajst-32394	13	17	robust	robust	ADJ
ajst-32394	13	18	machine	machine	NOUN
ajst-32394	13	19	learning	learning	NOUN
ajst-32394	13	20	models	model	NOUN
ajst-32394	13	21	from	from	ADP
ajst-32394	13	22	public	public	ADJ
ajst-32394	13	23	or	or	CCONJ
ajst-32394	13	24	user	user	NOUN
ajst-32394	13	25	-	-	PUNCT
ajst-32394	13	26	owned	own	VERB
ajst-32394	13	27	datasets	dataset	NOUN
ajst-32394	13	28	,	,	PUNCT
ajst-32394	13	29	comparable	comparable	ADJ
ajst-32394	13	30	in	in	ADP
ajst-32394	13	31	performance	performance	NOUN
ajst-32394	13	32	to	to	ADP
ajst-32394	13	33	those	those	PRON
ajst-32394	13	34	generated	generate	VERB
ajst-32394	13	35	by	by	ADP
ajst-32394	13	36	alternative	alternative	ADJ
ajst-32394	13	37	tools	tool	NOUN
ajst-32394	13	38	[	[	X
ajst-32394	13	39	4	4	NUM
ajst-32394	13	40	]	]	PUNCT
ajst-32394	13	41	.	.	PUNCT
ajst-32394	14	1	the	the	DET
ajst-32394	14	2	evolution	evolution	NOUN
ajst-32394	14	3	of	of	ADP
ajst-32394	14	4	machine	machine	NOUN
ajst-32394	14	5	learning	learning	NOUN
ajst-32394	14	6	in	in	ADP
ajst-32394	14	7	toxicology	toxicology	NOUN
ajst-32394	14	8	has	have	AUX
ajst-32394	14	9	not	not	PART
ajst-32394	14	10	followed	follow	VERB
ajst-32394	14	11	a	a	DET
ajst-32394	14	12	straight	straight	ADJ
ajst-32394	14	13	path	path	NOUN
ajst-32394	14	14	of	of	ADP
ajst-32394	14	15	technical	technical	ADJ
ajst-32394	14	16	improvements	improvement	NOUN
ajst-32394	14	17	.	.	PUNCT
ajst-32394	15	1	instead	instead	ADV
ajst-32394	15	2	,	,	PUNCT
ajst-32394	15	3	it	it	PRON
ajst-32394	15	4	has	have	AUX
ajst-32394	15	5	responded	respond	VERB
ajst-32394	15	6	to	to	ADP
ajst-32394	15	7	the	the	DET
ajst-32394	15	8	growing	grow	VERB
ajst-32394	15	9	complexity	complexity	NOUN
ajst-32394	15	10	and	and	CCONJ
ajst-32394	15	11	amount	amount	NOUN
ajst-32394	15	12	of	of	ADP
ajst-32394	15	13	biological	biological	ADJ
ajst-32394	15	14	data	datum	NOUN
ajst-32394	15	15	.	.	PUNCT
ajst-32394	16	1	in	in	ADP
ajst-32394	16	2	the	the	DET
ajst-32394	16	3	beginning	beginning	NOUN
ajst-32394	16	4	,	,	PUNCT
ajst-32394	16	5	ml	ml	VERB
ajst-32394	16	6	was	be	AUX
ajst-32394	16	7	used	use	VERB
ajst-32394	16	8	for	for	ADP
ajst-32394	16	9	simple	simple	ADJ
ajst-32394	16	10	tasks	task	NOUN
ajst-32394	16	11	—	—	PUNCT
ajst-32394	16	12	mainly	mainly	ADV
ajst-32394	16	13	to	to	PART
ajst-32394	16	14	classify	classify	VERB
ajst-32394	16	15	compounds	compound	NOUN
ajst-32394	16	16	as	as	ADP
ajst-32394	16	17	toxic	toxic	ADJ
ajst-32394	16	18	or	or	CCONJ
ajst-32394	16	19	non	non	ADJ
ajst-32394	16	20	-	-	ADJ
ajst-32394	16	21	toxic	toxic	ADJ
ajst-32394	16	22	.	.	PUNCT
ajst-32394	17	1	these	these	DET
ajst-32394	17	2	early	early	ADJ
ajst-32394	17	3	methods	method	NOUN
ajst-32394	17	4	were	be	AUX
ajst-32394	17	5	basic	basic	ADJ
ajst-32394	17	6	by	by	ADP
ajst-32394	17	7	today	today	NOUN
ajst-32394	17	8	’s	’s	PART
ajst-32394	17	9	standards	standard	NOUN
ajst-32394	17	10	,	,	PUNCT
ajst-32394	17	11	but	but	CCONJ
ajst-32394	17	12	they	they	PRON
ajst-32394	17	13	already	already	ADV
ajst-32394	17	14	reduced	reduce	VERB
ajst-32394	17	15	the	the	DET
ajst-32394	17	16	need	need	NOUN
ajst-32394	17	17	for	for	ADP
ajst-32394	17	18	expert	expert	NOUN
ajst-32394	17	19	judgment	judgment	NOUN
ajst-32394	17	20	and	and	CCONJ
ajst-32394	17	21	offered	offer	VERB
ajst-32394	17	22	a	a	DET
ajst-32394	17	23	more	more	ADV
ajst-32394	17	24	consistent	consistent	ADJ
ajst-32394	17	25	way	way	NOUN
ajst-32394	17	26	to	to	PART
ajst-32394	17	27	replace	replace	VERB
ajst-32394	17	28	manual	manual	ADJ
ajst-32394	17	29	evaluation	evaluation	NOUN
ajst-32394	17	30	.	.	PUNCT
ajst-32394	18	1	one	one	NUM
ajst-32394	18	2	of	of	ADP
ajst-32394	18	3	the	the	DET
ajst-32394	18	4	first	first	ADJ
ajst-32394	18	5	clear	clear	ADJ
ajst-32394	18	6	examples	example	NOUN
ajst-32394	18	7	came	come	VERB
ajst-32394	18	8	from	from	ADP
ajst-32394	18	9	studies	study	NOUN
ajst-32394	18	10	on	on	ADP
ajst-32394	18	11	zebrafish	zebrafish	ADJ
ajst-32394	18	12	embryos	embryo	NOUN
ajst-32394	18	13	.	.	PUNCT
ajst-32394	19	1	scientists	scientist	NOUN
ajst-32394	19	2	used	use	VERB
ajst-32394	19	3	ml	ml	NOUN
ajst-32394	19	4	to	to	PART
ajst-32394	19	5	analyze	analyze	VERB
ajst-32394	19	6	brightfield	brightfield	NOUN
ajst-32394	19	7	images	image	NOUN
ajst-32394	19	8	and	and	CCONJ
ajst-32394	19	9	spot	spot	NOUN
ajst-32394	19	10	developmental	developmental	ADJ
ajst-32394	19	11	problems	problem	NOUN
ajst-32394	19	12	in	in	ADP
ajst-32394	19	13	larvae	larvae	NOUN
ajst-32394	19	14	after	after	ADP
ajst-32394	19	15	three	three	NUM
ajst-32394	19	16	days	day	NOUN
ajst-32394	19	17	.	.	PUNCT
ajst-32394	20	1	the	the	DET
ajst-32394	20	2	results	result	NOUN
ajst-32394	20	3	were	be	AUX
ajst-32394	20	4	impressive	impressive	ADJ
ajst-32394	20	5	:	:	PUNCT
ajst-32394	20	6	the	the	DET
ajst-32394	20	7	model	model	NOUN
ajst-32394	20	8	agreed	agree	VERB
ajst-32394	20	9	with	with	ADP
ajst-32394	20	10	expert	expert	NOUN
ajst-32394	20	11	judgments	judgment	NOUN
ajst-32394	20	12	in	in	ADP
ajst-32394	20	13	90–100	90–100	NUM
ajst-32394	20	14	%	%	NOUN
ajst-32394	20	15	of	of	ADP
ajst-32394	20	16	cases	case	NOUN
ajst-32394	20	17	across	across	ADP
ajst-32394	20	18	nine	nine	NUM
ajst-32394	20	19	out	out	ADP
ajst-32394	20	20	of	of	ADP
ajst-32394	20	21	eleven	eleven	NUM
ajst-32394	20	22	types	type	NOUN
ajst-32394	20	23	of	of	ADP
ajst-32394	20	24	defects	defect	NOUN
ajst-32394	20	25	[	[	X
ajst-32394	20	26	5	5	NUM
ajst-32394	20	27	]	]	PUNCT
ajst-32394	20	28	.	.	PUNCT
ajst-32394	21	1	this	this	PRON
ajst-32394	21	2	was	be	AUX
ajst-32394	21	3	more	more	ADJ
ajst-32394	21	4	than	than	ADP
ajst-32394	21	5	just	just	ADV
ajst-32394	21	6	a	a	DET
ajst-32394	21	7	technical	technical	ADJ
ajst-32394	21	8	win	win	NOUN
ajst-32394	21	9	—	—	PUNCT
ajst-32394	21	10	it	it	PRON
ajst-32394	21	11	showed	show	VERB
ajst-32394	21	12	that	that	DET
ajst-32394	21	13	automation	automation	NOUN
ajst-32394	21	14	could	could	AUX
ajst-32394	21	15	make	make	VERB
ajst-32394	21	16	phenotypic	phenotypic	NOUN
ajst-32394	21	17	screening	screen	VERB
ajst-32394	21	18	more	more	ADV
ajst-32394	21	19	reliable	reliable	ADJ
ajst-32394	21	20	and	and	CCONJ
ajst-32394	21	21	less	less	ADV
ajst-32394	21	22	dependent	dependent	ADJ
ajst-32394	21	23	on	on	ADP
ajst-32394	21	24	individual	individual	ADJ
ajst-32394	21	25	observers	observer	NOUN
ajst-32394	21	26	,	,	PUNCT
ajst-32394	21	27	an	an	DET
ajst-32394	21	28	issue	issue	NOUN
ajst-32394	21	29	that	that	PRON
ajst-32394	21	30	had	have	AUX
ajst-32394	21	31	long	long	ADV
ajst-32394	21	32	affected	affect	VERB
ajst-32394	21	33	this	this	DET
ajst-32394	21	34	field	field	NOUN
ajst-32394	21	35	.	.	PUNCT
ajst-32394	22	1	over	over	ADP
ajst-32394	22	2	time	time	NOUN
ajst-32394	22	3	,	,	PUNCT
ajst-32394	22	4	the	the	DET
ajst-32394	22	5	focus	focus	NOUN
ajst-32394	22	6	expanded	expand	VERB
ajst-32394	22	7	beyond	beyond	ADP
ajst-32394	22	8	simple	simple	ADJ
ajst-32394	22	9	classification	classification	NOUN
ajst-32394	22	10	.	.	PUNCT
ajst-32394	23	1	researchers	researcher	NOUN
ajst-32394	23	2	began	begin	VERB
ajst-32394	23	3	to	to	PART
ajst-32394	23	4	look	look	VERB
ajst-32394	23	5	at	at	ADP
ajst-32394	23	6	how	how	SCONJ
ajst-32394	23	7	molecular	molecular	ADJ
ajst-32394	23	8	features	feature	NOUN
ajst-32394	23	9	relate	relate	VERB
ajst-32394	23	10	to	to	ADP
ajst-32394	23	11	actual	actual	ADJ
ajst-32394	23	12	toxic	toxic	ADJ
ajst-32394	23	13	effects	effect	NOUN
ajst-32394	23	14	,	,	PUNCT
ajst-32394	23	15	leading	lead	VERB
ajst-32394	23	16	to	to	ADP
ajst-32394	23	17	models	model	NOUN
ajst-32394	23	18	like	like	ADP
ajst-32394	23	19	quantitative	quantitative	ADJ
ajst-32394	23	20	biological	biological	ADJ
ajst-32394	23	21	activity	activity	NOUN
ajst-32394	23	22	relationship	relationship	NOUN
ajst-32394	23	23	(	(	PUNCT
ajst-32394	23	24	qbar	qbar	NOUN
ajst-32394	23	25	)	)	PUNCT
ajst-32394	23	26	.	.	PUNCT
ajst-32394	24	1	unlike	unlike	ADP
ajst-32394	24	2	earlier	early	ADJ
ajst-32394	24	3	tools	tool	NOUN
ajst-32394	24	4	,	,	PUNCT
ajst-32394	24	5	qbar	qbar	PROPN
ajst-32394	24	6	used	use	VERB
ajst-32394	24	7	in	in	ADP
ajst-32394	24	8	vitro	vitro	X
ajst-32394	24	9	data	datum	NOUN
ajst-32394	24	10	to	to	PART
ajst-32394	24	11	predict	predict	VERB
ajst-32394	24	12	whether	whether	SCONJ
ajst-32394	24	13	a	a	DET
ajst-32394	24	14	203	203	NUM
ajst-32394	24	15	compound	compound	NOUN
ajst-32394	24	16	might	might	AUX
ajst-32394	24	17	cause	cause	VERB
ajst-32394	24	18	cancer	cancer	NOUN
ajst-32394	24	19	in	in	ADP
ajst-32394	24	20	living	live	VERB
ajst-32394	24	21	organisms	organism	NOUN
ajst-32394	24	22	.	.	PUNCT
ajst-32394	25	1	it	it	PRON
ajst-32394	25	2	also	also	ADV
ajst-32394	25	3	met	meet	VERB
ajst-32394	25	4	key	key	ADJ
ajst-32394	25	5	validation	validation	NOUN
ajst-32394	25	6	standards	standard	NOUN
ajst-32394	25	7	set	set	VERB
ajst-32394	25	8	by	by	ADP
ajst-32394	25	9	oecd	oecd	PROPN
ajst-32394	25	10	/	/	SYM
ajst-32394	25	11	reach	reach	NOUN
ajst-32394	25	12	[	[	X
ajst-32394	25	13	6	6	NUM
ajst-32394	25	14	]	]	PUNCT
ajst-32394	25	15	.	.	PUNCT
ajst-32394	26	1	more	more	ADV
ajst-32394	26	2	importantly	importantly	ADV
ajst-32394	26	3	,	,	PUNCT
ajst-32394	26	4	these	these	DET
ajst-32394	26	5	models	model	NOUN
ajst-32394	26	6	started	start	VERB
ajst-32394	26	7	using	use	VERB
ajst-32394	26	8	carefully	carefully	ADV
ajst-32394	26	9	chosen	choose	VERB
ajst-32394	26	10	descriptors	descriptor	NOUN
ajst-32394	26	11	—	—	PUNCT
ajst-32394	26	12	covering	cover	VERB
ajst-32394	26	13	chemical	chemical	NOUN
ajst-32394	26	14	,	,	PUNCT
ajst-32394	26	15	physical	physical	ADJ
ajst-32394	26	16	,	,	PUNCT
ajst-32394	26	17	and	and	CCONJ
ajst-32394	26	18	biological	biological	ADJ
ajst-32394	26	19	traits	trait	NOUN
ajst-32394	26	20	—	—	PUNCT
ajst-32394	26	21	that	that	PRON
ajst-32394	26	22	allowed	allow	VERB
ajst-32394	26	23	for	for	ADP
ajst-32394	26	24	deeper	deep	ADJ
ajst-32394	26	25	links	link	NOUN
ajst-32394	26	26	between	between	ADP
ajst-32394	26	27	structure	structure	NOUN
ajst-32394	26	28	and	and	CCONJ
ajst-32394	26	29	toxicity	toxicity	NOUN
ajst-32394	26	30	.	.	PUNCT
ajst-32394	27	1	this	this	DET
ajst-32394	27	2	shift	shift	NOUN
ajst-32394	27	3	marked	mark	VERB
ajst-32394	27	4	a	a	DET
ajst-32394	27	5	new	new	ADJ
ajst-32394	27	6	goal	goal	NOUN
ajst-32394	27	7	:	:	PUNCT
ajst-32394	27	8	not	not	PART
ajst-32394	27	9	only	only	ADV
ajst-32394	27	10	to	to	PART
ajst-32394	27	11	label	label	VERB
ajst-32394	27	12	,	,	PUNCT
ajst-32394	27	13	but	but	CCONJ
ajst-32394	27	14	to	to	PART
ajst-32394	27	15	understand	understand	VERB
ajst-32394	27	16	.	.	PUNCT
ajst-32394	28	1	the	the	DET
ajst-32394	28	2	real	real	ADJ
ajst-32394	28	3	turning	turning	NOUN
ajst-32394	28	4	point	point	NOUN
ajst-32394	28	5	came	come	VERB
ajst-32394	28	6	when	when	SCONJ
ajst-32394	28	7	high	high	ADJ
ajst-32394	28	8	-	-	PUNCT
ajst-32394	28	9	throughput	throughput	NOUN
ajst-32394	28	10	data	datum	NOUN
ajst-32394	28	11	became	become	VERB
ajst-32394	28	12	widely	widely	ADV
ajst-32394	28	13	available	available	ADJ
ajst-32394	28	14	.	.	PUNCT
ajst-32394	29	1	the	the	DET
ajst-32394	29	2	tox21	tox21	PROPN
ajst-32394	29	3	data	datum	NOUN
ajst-32394	29	4	challenge	challenge	NOUN
ajst-32394	29	5	in	in	ADP
ajst-32394	29	6	2014	2014	NUM
ajst-32394	29	7	was	be	AUX
ajst-32394	29	8	a	a	DET
ajst-32394	29	9	key	key	ADJ
ajst-32394	29	10	moment	moment	NOUN
ajst-32394	29	11	.	.	PUNCT
ajst-32394	30	1	it	it	PRON
ajst-32394	30	2	tested	test	VERB
ajst-32394	30	3	whether	whether	SCONJ
ajst-32394	30	4	computational	computational	ADJ
ajst-32394	30	5	methods	method	NOUN
ajst-32394	30	6	could	could	AUX
ajst-32394	30	7	accurately	accurately	ADV
ajst-32394	30	8	predict	predict	VERB
ajst-32394	30	9	how	how	SCONJ
ajst-32394	30	10	chemicals	chemical	NOUN
ajst-32394	30	11	affect	affect	VERB
ajst-32394	30	12	important	important	ADJ
ajst-32394	30	13	cellular	cellular	ADJ
ajst-32394	30	14	pathways	pathway	NOUN
ajst-32394	30	15	.	.	PUNCT
ajst-32394	31	1	among	among	ADP
ajst-32394	31	2	many	many	ADJ
ajst-32394	31	3	approaches	approach	NOUN
ajst-32394	31	4	,	,	PUNCT
ajst-32394	31	5	random	random	ADJ
ajst-32394	31	6	forest	forest	NOUN
ajst-32394	31	7	models	model	NOUN
ajst-32394	31	8	stood	stand	VERB
ajst-32394	31	9	out	out	ADP
ajst-32394	31	10	—	—	PUNCT
ajst-32394	31	11	especially	especially	ADV
ajst-32394	31	12	when	when	SCONJ
ajst-32394	31	13	combined	combine	VERB
ajst-32394	31	14	with	with	ADP
ajst-32394	31	15	maccs	maccs	NOUN
ajst-32394	31	16	fingerprints	fingerprint	NOUN
ajst-32394	31	17	and	and	CCONJ
ajst-32394	31	18	a	a	DET
ajst-32394	31	19	small	small	ADJ
ajst-32394	31	20	set	set	NOUN
ajst-32394	31	21	of	of	ADP
ajst-32394	31	22	13	13	NUM
ajst-32394	31	23	well	well	ADV
ajst-32394	31	24	-	-	PUNCT
ajst-32394	31	25	chosen	choose	VERB
ajst-32394	31	26	structural	structural	ADJ
ajst-32394	31	27	and	and	CCONJ
ajst-32394	31	28	statistical	statistical	ADJ
ajst-32394	31	29	features	feature	NOUN
ajst-32394	31	30	[	[	X
ajst-32394	31	31	7	7	NUM
ajst-32394	31	32	]	]	PUNCT
ajst-32394	31	33	.	.	PUNCT
ajst-32394	32	1	their	their	PRON
ajst-32394	32	2	performance	performance	NOUN
ajst-32394	32	3	,	,	PUNCT
ajst-32394	32	4	measured	measure	VERB
ajst-32394	32	5	by	by	ADP
ajst-32394	32	6	auc	auc	NOUN
ajst-32394	32	7	-	-	PUNCT
ajst-32394	32	8	roc	roc	NOUN
ajst-32394	32	9	,	,	PUNCT
ajst-32394	32	10	beat	beat	VERB
ajst-32394	32	11	many	many	ADJ
ajst-32394	32	12	other	other	ADJ
ajst-32394	32	13	methods	method	NOUN
ajst-32394	32	14	.	.	PUNCT
ajst-32394	33	1	this	this	PRON
ajst-32394	33	2	proved	prove	VERB
ajst-32394	33	3	that	that	SCONJ
ajst-32394	33	4	ml	ml	VERB
ajst-32394	33	5	could	could	AUX
ajst-32394	33	6	help	help	VERB
ajst-32394	33	7	prioritize	prioritize	VERB
ajst-32394	33	8	which	which	PRON
ajst-32394	33	9	compounds	compound	VERB
ajst-32394	33	10	to	to	PART
ajst-32394	33	11	study	study	VERB
ajst-32394	33	12	further	far	ADV
ajst-32394	33	13	,	,	PUNCT
ajst-32394	33	14	while	while	SCONJ
ajst-32394	33	15	reducing	reduce	VERB
ajst-32394	33	16	false	false	ADJ
ajst-32394	33	17	positives	positive	NOUN
ajst-32394	33	18	.	.	PUNCT
ajst-32394	34	1	this	this	DET
ajst-32394	34	2	history	history	NOUN
ajst-32394	34	3	shows	show	VERB
ajst-32394	34	4	more	more	ADJ
ajst-32394	34	5	than	than	ADP
ajst-32394	34	6	just	just	ADV
ajst-32394	34	7	better	well	ADJ
ajst-32394	34	8	tools	tool	NOUN
ajst-32394	34	9	—	—	PUNCT
ajst-32394	34	10	it	it	PRON
ajst-32394	34	11	reveals	reveal	VERB
ajst-32394	34	12	a	a	DET
ajst-32394	34	13	deep	deep	ADJ
ajst-32394	34	14	change	change	NOUN
ajst-32394	34	15	in	in	ADP
ajst-32394	34	16	how	how	SCONJ
ajst-32394	34	17	we	we	PRON
ajst-32394	34	18	study	study	VERB
ajst-32394	34	19	toxicity	toxicity	NOUN
ajst-32394	34	20	.	.	PUNCT
ajst-32394	35	1	machine	machine	NOUN
ajst-32394	35	2	learning	learning	NOUN
ajst-32394	35	3	has	have	AUX
ajst-32394	35	4	moved	move	VERB
ajst-32394	35	5	from	from	ADP
ajst-32394	35	6	being	be	AUX
ajst-32394	35	7	a	a	DET
ajst-32394	35	8	helper	helper	NOUN
ajst-32394	35	9	tool	tool	NOUN
ajst-32394	35	10	to	to	ADP
ajst-32394	35	11	becoming	become	VERB
ajst-32394	35	12	central	central	ADJ
ajst-32394	35	13	to	to	ADP
ajst-32394	35	14	network	network	NOUN
ajst-32394	35	15	-	-	PUNCT
ajst-32394	35	16	based	base	VERB
ajst-32394	35	17	toxicology	toxicology	NOUN
ajst-32394	35	18	,	,	PUNCT
ajst-32394	35	19	able	able	ADJ
ajst-32394	35	20	to	to	PART
ajst-32394	35	21	catch	catch	VERB
ajst-32394	35	22	complex	complex	ADJ
ajst-32394	35	23	,	,	PUNCT
ajst-32394	35	24	system	system	NOUN
ajst-32394	35	25	-	-	PUNCT
ajst-32394	35	26	wide	wide	ADJ
ajst-32394	35	27	effects	effect	NOUN
ajst-32394	35	28	that	that	PRON
ajst-32394	35	29	older	old	ADJ
ajst-32394	35	30	tests	test	NOUN
ajst-32394	35	31	often	often	ADV
ajst-32394	35	32	miss	miss	VERB
ajst-32394	35	33	.	.	PUNCT
ajst-32394	36	1	still	still	ADV
ajst-32394	36	2	,	,	PUNCT
ajst-32394	36	3	we	we	PRON
ajst-32394	36	4	must	must	AUX
ajst-32394	36	5	be	be	AUX
ajst-32394	36	6	careful	careful	ADJ
ajst-32394	36	7	.	.	PUNCT
ajst-32394	37	1	strong	strong	ADJ
ajst-32394	37	2	predictions	prediction	NOUN
ajst-32394	37	3	do	do	AUX
ajst-32394	37	4	not	not	PART
ajst-32394	37	5	always	always	ADV
ajst-32394	37	6	mean	mean	VERB
ajst-32394	37	7	we	we	PRON
ajst-32394	37	8	understand	understand	VERB
ajst-32394	37	9	the	the	DET
ajst-32394	37	10	underlying	underlie	VERB
ajst-32394	37	11	biology	biology	NOUN
ajst-32394	37	12	.	.	PUNCT
ajst-32394	38	1	as	as	SCONJ
ajst-32394	38	2	models	model	NOUN
ajst-32394	38	3	become	become	VERB
ajst-32394	38	4	more	more	ADV
ajst-32394	38	5	complex	complex	ADJ
ajst-32394	38	6	,	,	PUNCT
ajst-32394	38	7	we	we	PRON
ajst-32394	38	8	need	need	VERB
ajst-32394	38	9	greater	great	ADJ
ajst-32394	38	10	transparency	transparency	NOUN
ajst-32394	38	11	,	,	PUNCT
ajst-32394	38	12	solid	solid	ADJ
ajst-32394	38	13	validation	validation	NOUN
ajst-32394	38	14	,	,	PUNCT
ajst-32394	38	15	and	and	CCONJ
ajst-32394	38	16	thoughtful	thoughtful	ADJ
ajst-32394	38	17	review	review	NOUN
ajst-32394	38	18	.	.	PUNCT
ajst-32394	39	1	2	2	X
ajst-32394	39	2	.	.	X
ajst-32394	39	3	integration	integration	NOUN
ajst-32394	39	4	of	of	ADP
ajst-32394	39	5	machine	machine	NOUN
ajst-32394	39	6	learning	learn	VERB
ajst-32394	39	7	with	with	ADP
ajst-32394	39	8	toxicological	toxicological	ADJ
ajst-32394	39	9	databases	database	NOUN
ajst-32394	39	10	linking	link	VERB
ajst-32394	39	11	machine	machine	NOUN
ajst-32394	39	12	learning	learning	NOUN
ajst-32394	39	13	with	with	ADP
ajst-32394	39	14	toxicological	toxicological	ADJ
ajst-32394	39	15	databases	database	NOUN
ajst-32394	39	16	is	be	AUX
ajst-32394	39	17	not	not	PART
ajst-32394	39	18	just	just	ADV
ajst-32394	39	19	about	about	ADP
ajst-32394	39	20	using	use	VERB
ajst-32394	39	21	new	new	ADJ
ajst-32394	39	22	tools	tool	NOUN
ajst-32394	39	23	.	.	PUNCT
ajst-32394	40	1	it	it	PRON
ajst-32394	40	2	changes	change	VERB
ajst-32394	40	3	how	how	SCONJ
ajst-32394	40	4	we	we	PRON
ajst-32394	40	5	think	think	VERB
ajst-32394	40	6	about	about	ADP
ajst-32394	40	7	risk	risk	NOUN
ajst-32394	40	8	assessment	assessment	NOUN
ajst-32394	40	9	.	.	PUNCT
ajst-32394	41	1	in	in	ADP
ajst-32394	41	2	the	the	DET
ajst-32394	41	3	past	past	NOUN
ajst-32394	41	4	,	,	PUNCT
ajst-32394	41	5	these	these	DET
ajst-32394	41	6	databases	database	NOUN
ajst-32394	41	7	were	be	AUX
ajst-32394	41	8	simple	simple	ADJ
ajst-32394	41	9	storage	storage	NOUN
ajst-32394	41	10	systems	system	NOUN
ajst-32394	41	11	—	—	PUNCT
ajst-32394	41	12	places	place	NOUN
ajst-32394	41	13	to	to	PART
ajst-32394	41	14	keep	keep	VERB
ajst-32394	41	15	regulatory	regulatory	ADJ
ajst-32394	41	16	reports	report	NOUN
ajst-32394	41	17	,	,	PUNCT
ajst-32394	41	18	lab	lab	NOUN
ajst-32394	41	19	test	test	NOUN
ajst-32394	41	20	results	result	NOUN
ajst-32394	41	21	,	,	PUNCT
ajst-32394	41	22	and	and	CCONJ
ajst-32394	41	23	public	public	ADJ
ajst-32394	41	24	health	health	NOUN
ajst-32394	41	25	data	datum	NOUN
ajst-32394	41	26	.	.	PUNCT
ajst-32394	42	1	now	now	ADV
ajst-32394	42	2	,	,	PUNCT
ajst-32394	42	3	they	they	PRON
ajst-32394	42	4	are	be	AUX
ajst-32394	42	5	becoming	become	VERB
ajst-32394	42	6	active	active	ADJ
ajst-32394	42	7	tools	tool	NOUN
ajst-32394	42	8	for	for	ADP
ajst-32394	42	9	prediction	prediction	NOUN
ajst-32394	42	10	,	,	PUNCT
ajst-32394	42	11	guided	guide	VERB
ajst-32394	42	12	by	by	ADP
ajst-32394	42	13	ml	ml	NOUN
ajst-32394	42	14	models	model	NOUN
ajst-32394	42	15	instead	instead	ADV
ajst-32394	42	16	of	of	ADP
ajst-32394	42	17	passive	passive	ADJ
ajst-32394	42	18	searches	search	NOUN
ajst-32394	42	19	[	[	X
ajst-32394	42	20	8	8	NUM
ajst-32394	42	21	]	]	PUNCT
ajst-32394	42	22	.	.	PUNCT
ajst-32394	43	1	the	the	DET
ajst-32394	43	2	amount	amount	NOUN
ajst-32394	43	3	and	and	CCONJ
ajst-32394	43	4	variety	variety	NOUN
ajst-32394	43	5	of	of	ADP
ajst-32394	43	6	data	datum	NOUN
ajst-32394	43	7	have	have	AUX
ajst-32394	43	8	grown	grow	VERB
ajst-32394	43	9	too	too	ADV
ajst-32394	43	10	large	large	ADJ
ajst-32394	43	11	for	for	SCONJ
ajst-32394	43	12	people	people	NOUN
ajst-32394	43	13	to	to	PART
ajst-32394	43	14	handle	handle	VERB
ajst-32394	43	15	by	by	ADP
ajst-32394	43	16	hand	hand	NOUN
ajst-32394	43	17	.	.	PUNCT
ajst-32394	44	1	in	in	ADP
ajst-32394	44	2	this	this	DET
ajst-32394	44	3	setting	setting	NOUN
ajst-32394	44	4	,	,	PUNCT
ajst-32394	44	5	ml	ml	INTJ
ajst-32394	44	6	becomes	become	VERB
ajst-32394	44	7	essential	essential	ADJ
ajst-32394	44	8	—	—	PUNCT
ajst-32394	44	9	not	not	PART
ajst-32394	44	10	because	because	SCONJ
ajst-32394	44	11	it	it	PRON
ajst-32394	44	12	is	be	AUX
ajst-32394	44	13	flashy	flashy	ADJ
ajst-32394	44	14	,	,	PUNCT
ajst-32394	44	15	but	but	CCONJ
ajst-32394	44	16	because	because	SCONJ
ajst-32394	44	17	it	it	PRON
ajst-32394	44	18	can	can	AUX
ajst-32394	44	19	process	process	VERB
ajst-32394	44	20	large	large	ADJ
ajst-32394	44	21	datasets	dataset	NOUN
ajst-32394	44	22	consistently	consistently	ADV
ajst-32394	44	23	,	,	PUNCT
ajst-32394	44	24	where	where	SCONJ
ajst-32394	44	25	human	human	ADJ
ajst-32394	44	26	effort	effort	NOUN
ajst-32394	44	27	falls	fall	VERB
ajst-32394	44	28	short	short	ADJ
ajst-32394	44	29	.	.	PUNCT
ajst-32394	45	1	a	a	DET
ajst-32394	45	2	key	key	ADJ
ajst-32394	45	3	part	part	NOUN
ajst-32394	45	4	of	of	ADP
ajst-32394	45	5	this	this	DET
ajst-32394	45	6	change	change	NOUN
ajst-32394	45	7	is	be	AUX
ajst-32394	45	8	the	the	DET
ajst-32394	45	9	use	use	NOUN
ajst-32394	45	10	of	of	ADP
ajst-32394	45	11	modern	modern	ADJ
ajst-32394	45	12	qsar	qsar	NOUN
ajst-32394	45	13	models	model	NOUN
ajst-32394	45	14	built	build	VERB
ajst-32394	45	15	on	on	ADP
ajst-32394	45	16	ml	ml	ADP
ajst-32394	45	17	,	,	PUNCT
ajst-32394	45	18	not	not	PART
ajst-32394	45	19	old	old	ADJ
ajst-32394	45	20	statistical	statistical	ADJ
ajst-32394	45	21	methods	method	NOUN
ajst-32394	45	22	.	.	PUNCT
ajst-32394	46	1	these	these	DET
ajst-32394	46	2	models	model	NOUN
ajst-32394	46	3	learn	learn	VERB
ajst-32394	46	4	from	from	ADP
ajst-32394	46	5	large	large	ADJ
ajst-32394	46	6	sets	set	NOUN
ajst-32394	46	7	of	of	ADP
ajst-32394	46	8	chemical	chemical	NOUN
ajst-32394	46	9	and	and	CCONJ
ajst-32394	46	10	toxicity	toxicity	NOUN
ajst-32394	46	11	data	datum	NOUN
ajst-32394	46	12	to	to	PART
ajst-32394	46	13	link	link	VERB
ajst-32394	46	14	molecular	molecular	ADJ
ajst-32394	46	15	features	feature	NOUN
ajst-32394	46	16	to	to	ADP
ajst-32394	46	17	harmful	harmful	ADJ
ajst-32394	46	18	effects	effect	NOUN
ajst-32394	46	19	,	,	PUNCT
ajst-32394	46	20	such	such	ADJ
ajst-32394	46	21	as	as	ADP
ajst-32394	46	22	skin	skin	NOUN
ajst-32394	46	23	allergy	allergy	NOUN
ajst-32394	46	24	or	or	CCONJ
ajst-32394	46	25	organ	organ	NOUN
ajst-32394	46	26	damage	damage	NOUN
ajst-32394	46	27	.	.	PUNCT
ajst-32394	47	1	they	they	PRON
ajst-32394	47	2	do	do	AUX
ajst-32394	47	3	not	not	PART
ajst-32394	47	4	follow	follow	VERB
ajst-32394	47	5	fixed	fix	VERB
ajst-32394	47	6	rules	rule	NOUN
ajst-32394	47	7	but	but	CCONJ
ajst-32394	47	8	find	find	VERB
ajst-32394	47	9	patterns	pattern	NOUN
ajst-32394	47	10	in	in	ADP
ajst-32394	47	11	real	real	ADJ
ajst-32394	47	12	-	-	PUNCT
ajst-32394	47	13	world	world	NOUN
ajst-32394	47	14	data	datum	NOUN
ajst-32394	47	15	.	.	PUNCT
ajst-32394	48	1	their	their	PRON
ajst-32394	48	2	role	role	NOUN
ajst-32394	48	3	goes	go	VERB
ajst-32394	48	4	beyond	beyond	ADP
ajst-32394	48	5	making	make	VERB
ajst-32394	48	6	predictions	prediction	NOUN
ajst-32394	48	7	.	.	PUNCT
ajst-32394	49	1	they	they	PRON
ajst-32394	49	2	also	also	ADV
ajst-32394	49	3	reveal	reveal	VERB
ajst-32394	49	4	problems	problem	NOUN
ajst-32394	49	5	in	in	ADP
ajst-32394	49	6	current	current	ADJ
ajst-32394	49	7	testing	testing	NOUN
ajst-32394	49	8	practices	practice	NOUN
ajst-32394	49	9	,	,	PUNCT
ajst-32394	49	10	for	for	ADP
ajst-32394	49	11	example	example	NOUN
ajst-32394	49	12	,	,	PUNCT
ajst-32394	49	13	differences	difference	NOUN
ajst-32394	49	14	between	between	ADP
ajst-32394	49	15	labs	lab	NOUN
ajst-32394	49	16	in	in	ADP
ajst-32394	49	17	animal	animal	NOUN
ajst-32394	49	18	studies	study	NOUN
ajst-32394	49	19	,	,	PUNCT
ajst-32394	49	20	or	or	CCONJ
ajst-32394	49	21	unclear	unclear	ADJ
ajst-32394	49	22	criteria	criterion	NOUN
ajst-32394	49	23	like	like	ADP
ajst-32394	49	24	those	those	PRON
ajst-32394	49	25	used	use	VERB
ajst-32394	49	26	in	in	ADP
ajst-32394	49	27	the	the	DET
ajst-32394	49	28	draize	draize	NOUN
ajst-32394	49	29	eye	eye	NOUN
ajst-32394	49	30	test	test	NOUN
ajst-32394	49	31	[	[	X
ajst-32394	49	32	9,10	9,10	NUM
ajst-32394	49	33	]	]	X
ajst-32394	49	34	.	.	PUNCT
ajst-32394	50	1	this	this	DET
ajst-32394	50	2	kind	kind	NOUN
ajst-32394	50	3	of	of	ADP
ajst-32394	50	4	insight	insight	NOUN
ajst-32394	50	5	is	be	AUX
ajst-32394	50	6	often	often	ADV
ajst-32394	50	7	ignored	ignore	VERB
ajst-32394	50	8	when	when	SCONJ
ajst-32394	50	9	only	only	ADJ
ajst-32394	50	10	model	model	NOUN
ajst-32394	50	11	accuracy	accuracy	NOUN
ajst-32394	50	12	is	be	AUX
ajst-32394	50	13	discussed	discuss	VERB
ajst-32394	50	14	.	.	PUNCT
ajst-32394	51	1	in	in	ADP
ajst-32394	51	2	the	the	DET
ajst-32394	51	3	context	context	NOUN
ajst-32394	51	4	of	of	ADP
ajst-32394	51	5	network	network	NOUN
ajst-32394	51	6	toxicology	toxicology	NOUN
ajst-32394	51	7	,	,	PUNCT
ajst-32394	51	8	this	this	DET
ajst-32394	51	9	integration	integration	NOUN
ajst-32394	51	10	takes	take	VERB
ajst-32394	51	11	on	on	ADP
ajst-32394	51	12	greater	great	ADJ
ajst-32394	51	13	meaning	meaning	NOUN
ajst-32394	51	14	.	.	PUNCT
ajst-32394	52	1	when	when	SCONJ
ajst-32394	52	2	databases	database	NOUN
ajst-32394	52	3	include	include	VERB
ajst-32394	52	4	ml	ml	NOUN
ajst-32394	52	5	-	-	PUNCT
ajst-32394	52	6	based	base	VERB
ajst-32394	52	7	predictions	prediction	NOUN
ajst-32394	52	8	,	,	PUNCT
ajst-32394	52	9	they	they	PRON
ajst-32394	52	10	can	can	AUX
ajst-32394	52	11	support	support	VERB
ajst-32394	52	12	knowledge	knowledge	NOUN
ajst-32394	52	13	graphs	graph	NOUN
ajst-32394	52	14	—	—	PUNCT
ajst-32394	52	15	networks	network	NOUN
ajst-32394	52	16	that	that	PRON
ajst-32394	52	17	connect	connect	VERB
ajst-32394	52	18	chemicals	chemical	NOUN
ajst-32394	52	19	,	,	PUNCT
ajst-32394	52	20	proteins	protein	NOUN
ajst-32394	52	21	,	,	PUNCT
ajst-32394	52	22	and	and	CCONJ
ajst-32394	52	23	biological	biological	ADJ
ajst-32394	52	24	pathways	pathway	NOUN
ajst-32394	52	25	.	.	PUNCT
ajst-32394	53	1	the	the	DET
ajst-32394	53	2	links	link	NOUN
ajst-32394	53	3	in	in	ADP
ajst-32394	53	4	these	these	DET
ajst-32394	53	5	networks	network	NOUN
ajst-32394	53	6	are	be	AUX
ajst-32394	53	7	no	no	ADV
ajst-32394	53	8	longer	long	ADV
ajst-32394	53	9	simple	simple	ADJ
ajst-32394	53	10	yes	yes	ADV
ajst-32394	53	11	-	-	PUNCT
ajst-32394	53	12	or	or	CCONJ
ajst-32394	53	13	-	-	PUNCT
ajst-32394	53	14	no	no	PRON
ajst-32394	53	15	statements	statement	NOUN
ajst-32394	53	16	,	,	PUNCT
ajst-32394	53	17	but	but	CCONJ
ajst-32394	53	18	graded	grade	VERB
ajst-32394	53	19	probabilities	probability	NOUN
ajst-32394	53	20	,	,	PUNCT
ajst-32394	53	21	such	such	ADJ
ajst-32394	53	22	as	as	ADP
ajst-32394	53	23	the	the	DET
ajst-32394	53	24	chance	chance	NOUN
ajst-32394	53	25	that	that	SCONJ
ajst-32394	53	26	two	two	NUM
ajst-32394	53	27	chemicals	chemical	NOUN
ajst-32394	53	28	together	together	ADV
ajst-32394	53	29	might	might	AUX
ajst-32394	53	30	disrupt	disrupt	VERB
ajst-32394	53	31	a	a	DET
ajst-32394	53	32	cellular	cellular	ADJ
ajst-32394	53	33	pathway	pathway	NOUN
ajst-32394	53	34	.	.	PUNCT
ajst-32394	54	1	as	as	ADP
ajst-32394	54	2	a	a	DET
ajst-32394	54	3	result	result	NOUN
ajst-32394	54	4	,	,	PUNCT
ajst-32394	54	5	toxicology	toxicology	NOUN
ajst-32394	54	6	shifts	shift	NOUN
ajst-32394	54	7	from	from	ADP
ajst-32394	54	8	listing	list	VERB
ajst-32394	54	9	hazards	hazard	NOUN
ajst-32394	54	10	one	one	NUM
ajst-32394	54	11	by	by	ADP
ajst-32394	54	12	one	one	NUM
ajst-32394	54	13	to	to	PART
ajst-32394	54	14	forecast	forecast	VERB
ajst-32394	54	15	systemwide	systemwide	ADJ
ajst-32394	54	16	risks	risk	NOUN
ajst-32394	54	17	.	.	PUNCT
ajst-32394	55	1	you	you	PRON
ajst-32394	55	2	could	could	AUX
ajst-32394	55	3	even	even	ADV
ajst-32394	55	4	say	say	VERB
ajst-32394	55	5	the	the	DET
ajst-32394	55	6	database	database	NOUN
ajst-32394	55	7	starts	start	VERB
ajst-32394	55	8	to	to	PART
ajst-32394	55	9	act	act	VERB
ajst-32394	55	10	like	like	ADP
ajst-32394	55	11	a	a	DET
ajst-32394	55	12	forecasting	forecasting	NOUN
ajst-32394	55	13	tool	tool	NOUN
ajst-32394	55	14	—	—	PUNCT
ajst-32394	55	15	but	but	CCONJ
ajst-32394	55	16	only	only	ADV
ajst-32394	55	17	if	if	SCONJ
ajst-32394	55	18	we	we	PRON
ajst-32394	55	19	remember	remember	VERB
ajst-32394	55	20	that	that	SCONJ
ajst-32394	55	21	its	its	PRON
ajst-32394	55	22	value	value	NOUN
ajst-32394	55	23	comes	come	VERB
ajst-32394	55	24	from	from	ADP
ajst-32394	55	25	good	good	ADJ
ajst-32394	55	26	data	datum	NOUN
ajst-32394	55	27	and	and	CCONJ
ajst-32394	55	28	clear	clear	ADJ
ajst-32394	55	29	methods	method	NOUN
ajst-32394	55	30	.	.	PUNCT
ajst-32394	56	1	so	so	ADV
ajst-32394	56	2	we	we	PRON
ajst-32394	56	3	must	must	AUX
ajst-32394	56	4	balance	balance	VERB
ajst-32394	56	5	hope	hope	NOUN
ajst-32394	56	6	with	with	ADP
ajst-32394	56	7	caution	caution	NOUN
ajst-32394	56	8	.	.	PUNCT
ajst-32394	57	1	automation	automation	NOUN
ajst-32394	57	2	improves	improve	VERB
ajst-32394	57	3	speed	speed	NOUN
ajst-32394	57	4	and	and	CCONJ
ajst-32394	57	5	scale	scale	NOUN
ajst-32394	57	6	,	,	PUNCT
ajst-32394	57	7	but	but	CCONJ
ajst-32394	57	8	it	it	PRON
ajst-32394	57	9	can	can	AUX
ajst-32394	57	10	also	also	ADV
ajst-32394	57	11	hide	hide	VERB
ajst-32394	57	12	flaws	flaw	NOUN
ajst-32394	57	13	.	.	PUNCT
ajst-32394	58	1	if	if	SCONJ
ajst-32394	58	2	we	we	PRON
ajst-32394	58	3	let	let	VERB
ajst-32394	58	4	ml	ml	PART
ajst-32394	58	5	models	model	NOUN
ajst-32394	58	6	run	run	VERB
ajst-32394	58	7	without	without	ADP
ajst-32394	58	8	close	close	ADJ
ajst-32394	58	9	review	review	NOUN
ajst-32394	58	10	,	,	PUNCT
ajst-32394	58	11	we	we	PRON
ajst-32394	58	12	might	might	AUX
ajst-32394	58	13	replace	replace	VERB
ajst-32394	58	14	human	human	ADJ
ajst-32394	58	15	bias	bias	NOUN
ajst-32394	58	16	with	with	ADP
ajst-32394	58	17	a	a	DET
ajst-32394	58	18	different	different	ADJ
ajst-32394	58	19	kind	kind	NOUN
ajst-32394	58	20	:	:	PUNCT
ajst-32394	58	21	hidden	hide	VERB
ajst-32394	58	22	errors	error	NOUN
ajst-32394	58	23	in	in	ADP
ajst-32394	58	24	algorithms	algorithm	NOUN
ajst-32394	58	25	that	that	PRON
ajst-32394	58	26	go	go	VERB
ajst-32394	58	27	unchecked	unchecked	ADJ
ajst-32394	58	28	.	.	PUNCT
ajst-32394	59	1	real	real	ADJ
ajst-32394	59	2	progress	progress	NOUN
ajst-32394	59	3	does	do	AUX
ajst-32394	59	4	not	not	PART
ajst-32394	59	5	come	come	VERB
ajst-32394	59	6	from	from	ADP
ajst-32394	59	7	faster	fast	ADJ
ajst-32394	59	8	answers	answer	NOUN
ajst-32394	59	9	,	,	PUNCT
ajst-32394	59	10	but	but	CCONJ
ajst-32394	59	11	from	from	ADP
ajst-32394	59	12	better	well	ADJ
ajst-32394	59	13	reasoning	reasoning	NOUN
ajst-32394	59	14	behind	behind	ADP
ajst-32394	59	15	them	they	PRON
ajst-32394	59	16	.	.	PUNCT
ajst-32394	60	1	3	3	X
ajst-32394	60	2	.	.	X
ajst-32394	60	3	machine	machine	NOUN
ajst-32394	60	4	learning	learning	NOUN
ajst-32394	60	5	in	in	ADP
ajst-32394	60	6	toxicological	toxicological	ADJ
ajst-32394	60	7	risk	risk	NOUN
ajst-32394	60	8	assessment	assessment	NOUN
ajst-32394	60	9	machine	machine	NOUN
ajst-32394	60	10	learning	learning	NOUN
ajst-32394	60	11	plays	play	VERB
ajst-32394	60	12	a	a	DET
ajst-32394	60	13	crucial	crucial	ADJ
ajst-32394	60	14	role	role	NOUN
ajst-32394	60	15	in	in	ADP
ajst-32394	60	16	toxicological	toxicological	ADJ
ajst-32394	60	17	risk	risk	NOUN
ajst-32394	60	18	assessment	assessment	NOUN
ajst-32394	60	19	by	by	ADP
ajst-32394	60	20	effectively	effectively	ADV
ajst-32394	60	21	processing	process	VERB
ajst-32394	60	22	diverse	diverse	ADJ
ajst-32394	60	23	,	,	PUNCT
ajst-32394	60	24	high	high	ADJ
ajst-32394	60	25	-	-	PUNCT
ajst-32394	60	26	dimensional	dimensional	ADJ
ajst-32394	60	27	data	datum	NOUN
ajst-32394	60	28	to	to	PART
ajst-32394	60	29	identify	identify	VERB
ajst-32394	60	30	subtle	subtle	ADJ
ajst-32394	60	31	hazard	hazard	NOUN
ajst-32394	60	32	signals	signal	NOUN
ajst-32394	60	33	that	that	SCONJ
ajst-32394	60	34	conventional	conventional	ADJ
ajst-32394	60	35	analyses	analysis	NOUN
ajst-32394	60	36	may	may	AUX
ajst-32394	60	37	not	not	PART
ajst-32394	60	38	detect	detect	VERB
ajst-32394	60	39	[	[	PUNCT
ajst-32394	60	40	11].by	11].by	NUM
ajst-32394	60	41	fusing	fuse	VERB
ajst-32394	60	42	toxicogenomics	toxicogenomic	NOUN
ajst-32394	60	43	,	,	PUNCT
ajst-32394	60	44	high	high	ADJ
ajst-32394	60	45	-	-	PUNCT
ajst-32394	60	46	throughput	throughput	NOUN
ajst-32394	60	47	screening	screening	NOUN
ajst-32394	60	48	,	,	PUNCT
ajst-32394	60	49	and	and	CCONJ
ajst-32394	60	50	chemical	chemical	NOUN
ajst-32394	60	51	informatics	informatic	NOUN
ajst-32394	60	52	,	,	PUNCT
ajst-32394	60	53	ml	ml	AUX
ajst-32394	60	54	refines	refine	VERB
ajst-32394	60	55	probabilistic	probabilistic	ADJ
ajst-32394	60	56	evaluations	evaluation	NOUN
ajst-32394	60	57	of	of	ADP
ajst-32394	60	58	chemical	chemical	ADJ
ajst-32394	60	59	perils	peril	NOUN
ajst-32394	60	60	,	,	PUNCT
ajst-32394	60	61	aligning	align	VERB
ajst-32394	60	62	with	with	ADP
ajst-32394	60	63	the	the	DET
ajst-32394	60	64	21st	21st	ADJ
ajst-32394	60	65	-	-	PUNCT
ajst-32394	60	66	century	century	NOUN
ajst-32394	60	67	vision	vision	NOUN
ajst-32394	60	68	of	of	ADP
ajst-32394	60	69	pathwaycentric	pathwaycentric	ADJ
ajst-32394	60	70	,	,	PUNCT
ajst-32394	60	71	animal	animal	NOUN
ajst-32394	60	72	-	-	PUNCT
ajst-32394	60	73	sparing	spare	VERB
ajst-32394	60	74	paradigms	paradigm	NOUN
ajst-32394	60	75	as	as	SCONJ
ajst-32394	60	76	envisioned	envision	VERB
ajst-32394	60	77	by	by	ADP
ajst-32394	60	78	the	the	DET
ajst-32394	60	79	u.s	u.s	PROPN
ajst-32394	60	80	.	.	PROPN
ajst-32394	60	81	national	national	PROPN
ajst-32394	60	82	academy	academy	PROPN
ajst-32394	60	83	of	of	ADP
ajst-32394	60	84	sciences	sciences	PROPN
ajst-32394	61	1	[	[	X
ajst-32394	61	2	12	12	NUM
ajst-32394	61	3	]	]	PUNCT
ajst-32394	61	4	.	.	PUNCT
ajst-32394	62	1	this	this	DET
ajst-32394	62	2	204	204	NUM
ajst-32394	62	3	shift	shift	NOUN
ajst-32394	62	4	empowers	empower	NOUN
ajst-32394	62	5	regulators	regulator	NOUN
ajst-32394	62	6	and	and	CCONJ
ajst-32394	62	7	industries	industry	NOUN
ajst-32394	62	8	to	to	PART
ajst-32394	62	9	triage	triage	NOUN
ajst-32394	62	10	exposures	exposure	NOUN
ajst-32394	62	11	,	,	PUNCT
ajst-32394	62	12	prioritizing	prioritize	VERB
ajst-32394	62	13	interventions	intervention	NOUN
ajst-32394	62	14	where	where	SCONJ
ajst-32394	62	15	risks	risk	NOUN
ajst-32394	62	16	loom	loom	VERB
ajst-32394	62	17	largest	large	ADJ
ajst-32394	62	18	.	.	PUNCT
ajst-32394	63	1	a	a	DET
ajst-32394	63	2	hallmark	hallmark	ADJ
ajst-32394	63	3	application	application	NOUN
ajst-32394	63	4	resides	reside	VERB
ajst-32394	63	5	in	in	ADP
ajst-32394	63	6	prognosticating	prognosticate	VERB
ajst-32394	63	7	nuclear	nuclear	ADJ
ajst-32394	63	8	receptor	receptor	NOUN
ajst-32394	63	9	modulators	modulator	NOUN
ajst-32394	63	10	,	,	PUNCT
ajst-32394	63	11	pivotal	pivotal	ADJ
ajst-32394	63	12	to	to	PART
ajst-32394	63	13	endocrine	endocrine	VERB
ajst-32394	63	14	and	and	CCONJ
ajst-32394	63	15	oncogenic	oncogenic	ADJ
ajst-32394	63	16	disruptions	disruption	NOUN
ajst-32394	63	17	.	.	PUNCT
ajst-32394	64	1	the	the	DET
ajst-32394	64	2	nura	nura	NOUN
ajst-32394	64	3	dataset	dataset	PROPN
ajst-32394	64	4	,	,	PUNCT
ajst-32394	64	5	meticulously	meticulously	ADV
ajst-32394	64	6	curated	curate	VERB
ajst-32394	64	7	from	from	ADP
ajst-32394	64	8	toxicological	toxicological	ADJ
ajst-32394	64	9	and	and	CCONJ
ajst-32394	64	10	pharmacological	pharmacological	ADJ
ajst-32394	64	11	vaults	vault	NOUN
ajst-32394	64	12	,	,	PUNCT
ajst-32394	64	13	amalgamates	amalgamate	VERB
ajst-32394	64	14	bioactivity	bioactivity	NOUN
ajst-32394	64	15	annotations	annotation	NOUN
ajst-32394	64	16	for	for	ADP
ajst-32394	64	17	15,247	15,247	NUM
ajst-32394	64	18	molecules	molecule	NOUN
ajst-32394	64	19	across	across	ADP
ajst-32394	64	20	11	11	NUM
ajst-32394	64	21	nuclear	nuclear	ADJ
ajst-32394	64	22	receptors	receptor	NOUN
ajst-32394	64	23	,	,	PUNCT
ajst-32394	64	24	furnishing	furnish	VERB
ajst-32394	64	25	a	a	DET
ajst-32394	64	26	unified	unified	ADJ
ajst-32394	64	27	scaffold	scaffold	NOUN
ajst-32394	64	28	for	for	ADP
ajst-32394	64	29	ml	ml	NOUN
ajst-32394	64	30	training	training	NOUN
ajst-32394	64	31	[	[	X
ajst-32394	64	32	13	13	NUM
ajst-32394	64	33	]	]	PUNCT
ajst-32394	64	34	.	.	PUNCT
ajst-32394	65	1	algorithms	algorithm	NOUN
ajst-32394	65	2	like	like	ADP
ajst-32394	65	3	random	random	ADJ
ajst-32394	65	4	forests	forest	NOUN
ajst-32394	65	5	or	or	CCONJ
ajst-32394	65	6	gradient	gradient	NOUN
ajst-32394	65	7	boosting	boost	VERB
ajst-32394	65	8	dissect	dissect	NOUN
ajst-32394	65	9	ligand	ligand	NOUN
ajst-32394	65	10	-	-	PUNCT
ajst-32394	65	11	receptor	receptor	NOUN
ajst-32394	65	12	affinities	affinity	NOUN
ajst-32394	65	13	,	,	PUNCT
ajst-32394	65	14	forecasting	forecasting	NOUN
ajst-32394	65	15	modulatory	modulatory	ADJ
ajst-32394	65	16	potencies	potency	NOUN
ajst-32394	65	17	with	with	ADP
ajst-32394	65	18	balanced	balanced	ADJ
ajst-32394	65	19	accuracies	accuracy	NOUN
ajst-32394	65	20	often	often	ADV
ajst-32394	65	21	exceeding	exceed	VERB
ajst-32394	65	22	85	85	NUM
ajst-32394	65	23	%	%	NOUN
ajst-32394	65	24	.	.	PUNCT
ajst-32394	66	1	such	such	ADJ
ajst-32394	66	2	models	model	NOUN
ajst-32394	66	3	not	not	PART
ajst-32394	66	4	only	only	ADV
ajst-32394	66	5	flag	flag	NOUN
ajst-32394	66	6	potential	potential	ADJ
ajst-32394	66	7	xenoestrogens	xenoestrogen	NOUN
ajst-32394	66	8	or	or	CCONJ
ajst-32394	66	9	antiandrogens	antiandrogen	NOUN
ajst-32394	66	10	but	but	CCONJ
ajst-32394	66	11	also	also	ADV
ajst-32394	66	12	elucidate	elucidate	VERB
ajst-32394	66	13	structure	structure	NOUN
ajst-32394	66	14	-	-	PUNCT
ajst-32394	66	15	activity	activity	NOUN
ajst-32394	66	16	motifs	motif	NOUN
ajst-32394	66	17	,	,	PUNCT
ajst-32394	66	18	informing	inform	VERB
ajst-32394	66	19	safer	safe	ADJ
ajst-32394	66	20	analog	analog	NOUN
ajst-32394	66	21	design	design	NOUN
ajst-32394	66	22	in	in	ADP
ajst-32394	66	23	agrochemicals	agrochemical	NOUN
ajst-32394	66	24	and	and	CCONJ
ajst-32394	66	25	pharmaceuticals	pharmaceutical	NOUN
ajst-32394	66	26	.	.	PUNCT
ajst-32394	67	1	recent	recent	ADJ
ajst-32394	67	2	extensions	extension	NOUN
ajst-32394	67	3	,	,	PUNCT
ajst-32394	67	4	incorporating	incorporate	VERB
ajst-32394	67	5	deep	deep	ADJ
ajst-32394	67	6	learning	learning	NOUN
ajst-32394	67	7	,	,	PUNCT
ajst-32394	67	8	have	have	AUX
ajst-32394	67	9	amplified	amplify	VERB
ajst-32394	67	10	external	external	ADJ
ajst-32394	67	11	generalizability	generalizability	NOUN
ajst-32394	67	12	,	,	PUNCT
ajst-32394	67	13	as	as	SCONJ
ajst-32394	67	14	seen	see	VERB
ajst-32394	67	15	in	in	ADP
ajst-32394	67	16	tox21	tox21	PROPN
ajst-32394	67	17	-	-	PUNCT
ajst-32394	67	18	inspired	inspire	VERB
ajst-32394	67	19	frameworks	framework	NOUN
ajst-32394	67	20	that	that	PRON
ajst-32394	67	21	predict	predict	VERB
ajst-32394	67	22	pathway	pathway	NOUN
ajst-32394	67	23	interferences	interference	NOUN
ajst-32394	67	24	with	with	ADP
ajst-32394	67	25	aucs	aucs	NOUN
ajst-32394	67	26	nearing	near	VERB
ajst-32394	67	27	0.90	0.90	NUM
ajst-32394	67	28	,	,	PUNCT
ajst-32394	67	29	thereby	thereby	ADV
ajst-32394	67	30	streamlining	streamline	VERB
ajst-32394	67	31	reach	reach	VERB
ajst-32394	67	32	dossiers	dossier	NOUN
ajst-32394	67	33	[	[	X
ajst-32394	67	34	14	14	NUM
ajst-32394	67	35	]	]	PUNCT
ajst-32394	67	36	.	.	PUNCT
ajst-32394	68	1	in	in	ADP
ajst-32394	68	2	non	non	ADJ
ajst-32394	68	3	-	-	ADJ
ajst-32394	68	4	targeted	targeted	ADJ
ajst-32394	68	5	screening	screening	NOUN
ajst-32394	68	6	,	,	PUNCT
ajst-32394	68	7	ml	ml	AUX
ajst-32394	68	8	enhances	enhance	VERB
ajst-32394	68	9	analytical	analytical	ADJ
ajst-32394	68	10	workflows	workflow	NOUN
ajst-32394	68	11	,	,	PUNCT
ajst-32394	68	12	particularly	particularly	ADV
ajst-32394	68	13	by	by	ADP
ajst-32394	68	14	improving	improve	VERB
ajst-32394	68	15	the	the	DET
ajst-32394	68	16	compatibility	compatibility	NOUN
ajst-32394	68	17	of	of	ADP
ajst-32394	68	18	liquid	liquid	ADJ
ajst-32394	68	19	chromatography	chromatography	NOUN
ajst-32394	68	20	-	-	PUNCT
ajst-32394	68	21	mass	mass	NOUN
ajst-32394	68	22	spectrometry	spectrometry	NOUN
ajst-32394	68	23	(	(	PUNCT
ajst-32394	68	24	lc	lc	PROPN
ajst-32394	68	25	-	-	PUNCT
ajst-32394	68	26	ms	ms	NOUN
ajst-32394	68	27	)	)	PUNCT
ajst-32394	68	28	for	for	ADP
ajst-32394	68	29	elucidating	elucidate	VERB
ajst-32394	68	30	suspect	suspect	NOUN
ajst-32394	68	31	lists	list	NOUN
ajst-32394	68	32	in	in	ADP
ajst-32394	68	33	environmental	environmental	ADJ
ajst-32394	68	34	forensics	forensic	NOUN
ajst-32394	68	35	.	.	PUNCT
ajst-32394	69	1	feature	feature	NOUN
ajst-32394	69	2	-	-	PUNCT
ajst-32394	69	3	engineered	engineer	VERB
ajst-32394	69	4	models	model	NOUN
ajst-32394	69	5	,	,	PUNCT
ajst-32394	69	6	blending	blend	VERB
ajst-32394	69	7	molecular	molecular	ADJ
ajst-32394	69	8	descriptors	descriptor	NOUN
ajst-32394	69	9	with	with	ADP
ajst-32394	69	10	spectral	spectral	ADJ
ajst-32394	69	11	heuristics	heuristic	NOUN
ajst-32394	69	12	,	,	PUNCT
ajst-32394	69	13	elevate	elevate	VERB
ajst-32394	69	14	predictions	prediction	NOUN
ajst-32394	69	15	of	of	ADP
ajst-32394	69	16	compound	compound	NOUN
ajst-32394	69	17	detectability	detectability	NOUN
ajst-32394	69	18	,	,	PUNCT
ajst-32394	69	19	attaining	attain	VERB
ajst-32394	69	20	balanced	balanced	ADJ
ajst-32394	69	21	accuracies	accuracy	NOUN
ajst-32394	69	22	of	of	ADP
ajst-32394	69	23	0.84	0.84	NUM
ajst-32394	69	24	in	in	ADP
ajst-32394	69	25	positive	positive	ADJ
ajst-32394	69	26	ionization	ionization	NOUN
ajst-32394	69	27	and	and	CCONJ
ajst-32394	69	28	0.85	0.85	NUM
ajst-32394	69	29	in	in	ADP
ajst-32394	69	30	negative	negative	ADJ
ajst-32394	69	31	modes	mode	NOUN
ajst-32394	69	32	,	,	PUNCT
ajst-32394	69	33	with	with	ADP
ajst-32394	69	34	matthews	matthews	NOUN
ajst-32394	69	35	correlation	correlation	NOUN
ajst-32394	69	36	coefficients	coefficient	NOUN
ajst-32394	69	37	of	of	ADP
ajst-32394	69	38	0.66	0.66	NUM
ajst-32394	69	39	-	-	SYM
ajst-32394	69	40	0.68	0.68	NUM
ajst-32394	69	41	on	on	ADP
ajst-32394	69	42	external	external	ADJ
ajst-32394	69	43	benchmarks	benchmark	NOUN
ajst-32394	69	44	[	[	X
ajst-32394	69	45	15	15	NUM
ajst-32394	69	46	]	]	PUNCT
ajst-32394	69	47	.	.	PUNCT
ajst-32394	70	1	this	this	DET
ajst-32394	70	2	interpretability	interpretability	NOUN
ajst-32394	70	3	,	,	PUNCT
ajst-32394	70	4	via	via	ADP
ajst-32394	70	5	techniques	technique	NOUN
ajst-32394	70	6	like	like	ADP
ajst-32394	70	7	shap	shap	NOUN
ajst-32394	70	8	,	,	PUNCT
ajst-32394	70	9	demystifies	demystifie	NOUN
ajst-32394	70	10	black	black	ADJ
ajst-32394	70	11	-	-	PUNCT
ajst-32394	70	12	box	box	NOUN
ajst-32394	70	13	decisions	decision	NOUN
ajst-32394	70	14	,	,	PUNCT
ajst-32394	70	15	revealing	reveal	VERB
ajst-32394	70	16	physicochemical	physicochemical	ADJ
ajst-32394	70	17	drivers	driver	NOUN
ajst-32394	70	18	like	like	ADP
ajst-32394	70	19	logp	logp	NOUN
ajst-32394	70	20	or	or	CCONJ
ajst-32394	70	21	ionizability	ionizability	NOUN
ajst-32394	70	22	that	that	PRON
ajst-32394	70	23	dictate	dictate	VERB
ajst-32394	70	24	ionization	ionization	NOUN
ajst-32394	70	25	efficiency	efficiency	NOUN
ajst-32394	70	26	.	.	PUNCT
ajst-32394	71	1	by	by	ADP
ajst-32394	71	2	curbing	curb	VERB
ajst-32394	71	3	false	false	ADJ
ajst-32394	71	4	negatives	negative	NOUN
ajst-32394	71	5	in	in	ADP
ajst-32394	71	6	untargeted	untargeted	ADJ
ajst-32394	71	7	assays	assay	NOUN
ajst-32394	71	8	,	,	PUNCT
ajst-32394	71	9	ml	ml	PUNCT
ajst-32394	71	10	accelerates	accelerate	VERB
ajst-32394	71	11	exposure	exposure	NOUN
ajst-32394	71	12	reconstructions	reconstruction	NOUN
ajst-32394	71	13	,	,	PUNCT
ajst-32394	71	14	crucial	crucial	ADJ
ajst-32394	71	15	for	for	ADP
ajst-32394	71	16	linking	link	VERB
ajst-32394	71	17	contaminants	contaminant	NOUN
ajst-32394	71	18	to	to	ADP
ajst-32394	71	19	health	health	NOUN
ajst-32394	71	20	endpoints	endpoint	NOUN
ajst-32394	71	21	in	in	ADP
ajst-32394	71	22	wastewater	wastewater	NOUN
ajst-32394	71	23	epidemiology	epidemiology	NOUN
ajst-32394	71	24	or	or	CCONJ
ajst-32394	71	25	consumer	consumer	NOUN
ajst-32394	71	26	products	product	NOUN
ajst-32394	71	27	.	.	PUNCT
ajst-32394	72	1	furthermore	furthermore	ADV
ajst-32394	72	2	,	,	PUNCT
ajst-32394	72	3	ml	ml	AUX
ajst-32394	72	4	catalyzes	catalyze	VERB
ajst-32394	72	5	integrated	integrate	VERB
ajst-32394	72	6	testing	testing	NOUN
ajst-32394	72	7	strategies	strategy	NOUN
ajst-32394	72	8	(	(	PUNCT
ajst-32394	72	9	its	its	PRON
ajst-32394	72	10	)	)	PUNCT
ajst-32394	72	11	,	,	PUNCT
ajst-32394	72	12	optimizing	optimize	VERB
ajst-32394	72	13	cost	cost	NOUN
ajst-32394	72	14	-	-	PUNCT
ajst-32394	72	15	sensitive	sensitive	ADJ
ajst-32394	72	16	hazard	hazard	NOUN
ajst-32394	72	17	classifications	classification	NOUN
ajst-32394	72	18	.	.	PUNCT
ajst-32394	73	1	within	within	ADP
ajst-32394	73	2	the	the	DET
ajst-32394	73	3	framework	framework	NOUN
ajst-32394	73	4	of	of	ADP
ajst-32394	73	5	mandatory	mandatory	ADJ
ajst-32394	73	6	testing	testing	NOUN
ajst-32394	73	7	requirements	requirement	NOUN
ajst-32394	73	8	for	for	ADP
ajst-32394	73	9	skin	skin	NOUN
ajst-32394	73	10	sensitization	sensitization	NOUN
ajst-32394	73	11	under	under	ADP
ajst-32394	73	12	the	the	DET
ajst-32394	73	13	ghs	ghs	PROPN
ajst-32394	73	14	classification	classification	NOUN
ajst-32394	73	15	system	system	NOUN
ajst-32394	73	16	,	,	PUNCT
ajst-32394	73	17	bayesian	bayesian	NOUN
ajst-32394	73	18	networks	network	NOUN
ajst-32394	73	19	,	,	PUNCT
ajst-32394	73	20	developed	develop	VERB
ajst-32394	73	21	through	through	ADP
ajst-32394	73	22	the	the	DET
ajst-32394	73	23	integration	integration	NOUN
ajst-32394	73	24	of	of	ADP
ajst-32394	73	25	operational	operational	ADJ
ajst-32394	73	26	research	research	NOUN
ajst-32394	73	27	and	and	CCONJ
ajst-32394	73	28	machine	machine	NOUN
ajst-32394	73	29	learning	learning	NOUN
ajst-32394	73	30	,	,	PUNCT
ajst-32394	73	31	have	have	AUX
ajst-32394	73	32	demonstrated	demonstrate	VERB
ajst-32394	73	33	superior	superior	ADJ
ajst-32394	73	34	performance	performance	NOUN
ajst-32394	73	35	relative	relative	ADJ
ajst-32394	73	36	to	to	ADP
ajst-32394	73	37	traditional	traditional	ADJ
ajst-32394	73	38	mechanistic	mechanistic	ADJ
ajst-32394	73	39	causal	causal	ADJ
ajst-32394	73	40	models	model	NOUN
ajst-32394	73	41	.	.	PUNCT
ajst-32394	74	1	these	these	DET
ajst-32394	74	2	networks	network	NOUN
ajst-32394	74	3	have	have	AUX
ajst-32394	74	4	achieved	achieve	VERB
ajst-32394	74	5	an	an	DET
ajst-32394	74	6	accuracy	accuracy	NOUN
ajst-32394	74	7	of	of	ADP
ajst-32394	74	8	90	90	NUM
ajst-32394	74	9	%	%	NOUN
ajst-32394	74	10	,	,	PUNCT
ajst-32394	74	11	a	a	DET
ajst-32394	74	12	sensitivity	sensitivity	NOUN
ajst-32394	74	13	of	of	ADP
ajst-32394	74	14	93	93	NUM
ajst-32394	74	15	%	%	NOUN
ajst-32394	74	16	,	,	PUNCT
ajst-32394	74	17	and	and	CCONJ
ajst-32394	74	18	a	a	DET
ajst-32394	74	19	specificity	specificity	NOUN
ajst-32394	74	20	of	of	ADP
ajst-32394	74	21	84	84	NUM
ajst-32394	74	22	%	%	NOUN
ajst-32394	74	23	,	,	PUNCT
ajst-32394	74	24	while	while	SCONJ
ajst-32394	74	25	significantly	significantly	ADV
ajst-32394	74	26	simplifying	simplify	VERB
ajst-32394	74	27	the	the	DET
ajst-32394	74	28	testing	testing	NOUN
ajst-32394	74	29	procedures	procedure	NOUN
ajst-32394	74	30	[	[	X
ajst-32394	74	31	16	16	NUM
ajst-32394	74	32	]	]	PUNCT
ajst-32394	74	33	.	.	PUNCT
ajst-32394	75	1	utilizing	utilize	VERB
ajst-32394	75	2	decision	decision	NOUN
ajst-32394	75	3	trees	tree	NOUN
ajst-32394	75	4	,	,	PUNCT
ajst-32394	75	5	these	these	DET
ajst-32394	75	6	advanced	advanced	ADJ
ajst-32394	75	7	testing	testing	NOUN
ajst-32394	75	8	strategies	strategy	NOUN
ajst-32394	75	9	dynamically	dynamically	ADV
ajst-32394	75	10	select	select	VERB
ajst-32394	75	11	chemical	chemical	NOUN
ajst-32394	75	12	,	,	PUNCT
ajst-32394	75	13	in	in	ADP
ajst-32394	75	14	vitro	vitro	X
ajst-32394	75	15	,	,	PUNCT
ajst-32394	75	16	or	or	CCONJ
ajst-32394	75	17	computational	computational	ADJ
ajst-32394	75	18	evaluation	evaluation	NOUN
ajst-32394	75	19	methods	method	NOUN
ajst-32394	75	20	based	base	VERB
ajst-32394	75	21	on	on	ADP
ajst-32394	75	22	prior	prior	ADJ
ajst-32394	75	23	probabilities	probability	NOUN
ajst-32394	75	24	,	,	PUNCT
ajst-32394	75	25	thereby	thereby	ADV
ajst-32394	75	26	substantially	substantially	ADV
ajst-32394	75	27	reducing	reduce	VERB
ajst-32394	75	28	animal	animal	NOUN
ajst-32394	75	29	testing	testing	NOUN
ajst-32394	75	30	by	by	ADP
ajst-32394	75	31	up	up	ADP
ajst-32394	75	32	to	to	PART
ajst-32394	75	33	70	70	NUM
ajst-32394	75	34	%	%	NOUN
ajst-32394	75	35	in	in	ADP
ajst-32394	75	36	alignment	alignment	NOUN
ajst-32394	75	37	with	with	ADP
ajst-32394	75	38	oecd	oecd	PROPN
ajst-32394	75	39	guidelines	guideline	NOUN
ajst-32394	75	40	.	.	PUNCT
ajst-32394	76	1	furthermore	furthermore	ADV
ajst-32394	76	2	,	,	PUNCT
ajst-32394	76	3	emerging	emerge	VERB
ajst-32394	76	4	federated	federated	ADJ
ajst-32394	76	5	learning	learning	NOUN
ajst-32394	76	6	frameworks	framework	NOUN
ajst-32394	76	7	,	,	PUNCT
ajst-32394	76	8	as	as	SCONJ
ajst-32394	76	9	discussed	discuss	VERB
ajst-32394	76	10	in	in	ADP
ajst-32394	76	11	a	a	DET
ajst-32394	76	12	recent	recent	ADJ
ajst-32394	76	13	review	review	NOUN
ajst-32394	76	14	[	[	X
ajst-32394	76	15	17	17	NUM
ajst-32394	76	16	]	]	PUNCT
ajst-32394	76	17	,	,	PUNCT
ajst-32394	76	18	facilitate	facilitate	VERB
ajst-32394	76	19	the	the	DET
ajst-32394	76	20	integration	integration	NOUN
ajst-32394	76	21	of	of	ADP
ajst-32394	76	22	multi	multi	ADJ
ajst-32394	76	23	-	-	ADJ
ajst-32394	76	24	laboratory	laboratory	ADJ
ajst-32394	76	25	data	datum	NOUN
ajst-32394	76	26	while	while	SCONJ
ajst-32394	76	27	maintaining	maintain	VERB
ajst-32394	76	28	data	data	NOUN
ajst-32394	76	29	privacy	privacy	NOUN
ajst-32394	76	30	,	,	PUNCT
ajst-32394	76	31	thereby	thereby	ADV
ajst-32394	76	32	enhancing	enhance	VERB
ajst-32394	76	33	the	the	DET
ajst-32394	76	34	robustness	robustness	NOUN
ajst-32394	76	35	of	of	ADP
ajst-32394	76	36	models	model	NOUN
ajst-32394	76	37	for	for	ADP
ajst-32394	76	38	rare	rare	ADJ
ajst-32394	76	39	sensitizers	sensitizer	NOUN
ajst-32394	76	40	.	.	PUNCT
ajst-32394	77	1	in	in	ADP
ajst-32394	77	2	the	the	DET
ajst-32394	77	3	domain	domain	NOUN
ajst-32394	77	4	of	of	ADP
ajst-32394	77	5	network	network	NOUN
ajst-32394	77	6	toxicology	toxicology	NOUN
ajst-32394	77	7	,	,	PUNCT
ajst-32394	77	8	advancements	advancement	NOUN
ajst-32394	77	9	in	in	ADP
ajst-32394	77	10	machine	machine	NOUN
ajst-32394	77	11	learning	learning	NOUN
ajst-32394	77	12	have	have	AUX
ajst-32394	77	13	significantly	significantly	ADV
ajst-32394	77	14	enhanced	enhance	VERB
ajst-32394	77	15	the	the	DET
ajst-32394	77	16	capabilities	capability	NOUN
ajst-32394	77	17	of	of	ADP
ajst-32394	77	18	probabilistic	probabilistic	ADJ
ajst-32394	77	19	adverse	adverse	ADJ
ajst-32394	77	20	outcome	outcome	NOUN
ajst-32394	77	21	pathway	pathway	NOUN
ajst-32394	77	22	(	(	PUNCT
ajst-32394	77	23	aop	aop	PROPN
ajst-32394	77	24	)	)	PUNCT
ajst-32394	77	25	models	model	NOUN
ajst-32394	77	26	for	for	ADP
ajst-32394	77	27	risk	risk	NOUN
ajst-32394	77	28	assessment	assessment	NOUN
ajst-32394	77	29	.	.	PUNCT
ajst-32394	78	1	graph	graph	NOUN
ajst-32394	78	2	neural	neural	ADJ
ajst-32394	78	3	networks	network	NOUN
ajst-32394	78	4	have	have	AUX
ajst-32394	78	5	demonstrated	demonstrate	VERB
ajst-32394	78	6	the	the	DET
ajst-32394	78	7	ability	ability	NOUN
ajst-32394	78	8	to	to	PART
ajst-32394	78	9	simulate	simulate	VERB
ajst-32394	78	10	the	the	DET
ajst-32394	78	11	propagation	propagation	NOUN
ajst-32394	78	12	of	of	ADP
ajst-32394	78	13	uncertainty	uncertainty	NOUN
ajst-32394	78	14	from	from	ADP
ajst-32394	78	15	molecular	molecular	ADJ
ajst-32394	78	16	initiating	initiate	VERB
ajst-32394	78	17	events	event	NOUN
ajst-32394	78	18	to	to	PART
ajst-32394	78	19	apical	apical	ADJ
ajst-32394	78	20	adverse	adverse	ADJ
ajst-32394	78	21	outcomes	outcome	NOUN
ajst-32394	78	22	.	.	PUNCT
ajst-32394	79	1	by	by	ADP
ajst-32394	79	2	2025	2025	NUM
ajst-32394	79	3	,	,	PUNCT
ajst-32394	79	4	multimodal	multimodal	NOUN
ajst-32394	79	5	integration	integration	NOUN
ajst-32394	79	6	approaches	approach	NOUN
ajst-32394	79	7	have	have	AUX
ajst-32394	79	8	facilitated	facilitate	VERB
ajst-32394	79	9	the	the	DET
ajst-32394	79	10	amalgamation	amalgamation	NOUN
ajst-32394	79	11	of	of	ADP
ajst-32394	79	12	omics	omic	NOUN
ajst-32394	79	13	perturbations	perturbation	NOUN
ajst-32394	79	14	and	and	CCONJ
ajst-32394	79	15	exposure	exposure	NOUN
ajst-32394	79	16	parameters	parameter	NOUN
ajst-32394	79	17	,	,	PUNCT
ajst-32394	79	18	enabling	enable	VERB
ajst-32394	79	19	the	the	DET
ajst-32394	79	20	generation	generation	NOUN
ajst-32394	79	21	of	of	ADP
ajst-32394	79	22	hazard	hazard	NOUN
ajst-32394	79	23	quotients	quotient	NOUN
ajst-32394	79	24	for	for	ADP
ajst-32394	79	25	probabilistic	probabilistic	ADJ
ajst-32394	79	26	risk	risk	NOUN
ajst-32394	79	27	assessment	assessment	NOUN
ajst-32394	79	28	(	(	PUNCT
ajst-32394	79	29	pra	pra	PROPN
ajst-32394	79	30	)	)	PUNCT
ajst-32394	79	31	that	that	PRON
ajst-32394	79	32	markedly	markedly	ADV
ajst-32394	79	33	surpass	surpass	ADJ
ajst-32394	79	34	traditional	traditional	ADJ
ajst-32394	79	35	deterministic	deterministic	ADJ
ajst-32394	79	36	thresholds	threshold	NOUN
ajst-32394	79	37	[	[	X
ajst-32394	79	38	18	18	NUM
ajst-32394	79	39	]	]	PUNCT
ajst-32394	79	40	.	.	PUNCT
ajst-32394	80	1	despite	despite	SCONJ
ajst-32394	80	2	these	these	DET
ajst-32394	80	3	advancements	advancement	NOUN
ajst-32394	80	4	,	,	PUNCT
ajst-32394	80	5	several	several	ADJ
ajst-32394	80	6	challenges	challenge	NOUN
ajst-32394	80	7	persist	persist	VERB
ajst-32394	80	8	:	:	PUNCT
ajst-32394	80	9	data	datum	NOUN
ajst-32394	80	10	bias	bias	NOUN
ajst-32394	80	11	remains	remain	VERB
ajst-32394	80	12	prevalent	prevalent	ADJ
ajst-32394	80	13	in	in	ADP
ajst-32394	80	14	high	high	ADJ
ajst-32394	80	15	-	-	PUNCT
ajst-32394	80	16	production	production	NOUN
ajst-32394	80	17	-	-	PUNCT
ajst-32394	80	18	volume	volume	NOUN
ajst-32394	80	19	compounds	compound	NOUN
ajst-32394	80	20	,	,	PUNCT
ajst-32394	80	21	and	and	CCONJ
ajst-32394	80	22	the	the	DET
ajst-32394	80	23	interpretability	interpretability	NOUN
ajst-32394	80	24	of	of	ADP
ajst-32394	80	25	models	model	NOUN
ajst-32394	80	26	during	during	ADP
ajst-32394	80	27	regulatory	regulatory	ADJ
ajst-32394	80	28	review	review	NOUN
ajst-32394	80	29	is	be	AUX
ajst-32394	80	30	still	still	ADV
ajst-32394	80	31	limited	limited	ADJ
ajst-32394	80	32	.	.	PUNCT
ajst-32394	81	1	through	through	ADP
ajst-32394	81	2	meticulous	meticulous	ADJ
ajst-32394	81	3	data	datum	NOUN
ajst-32394	81	4	curation	curation	NOUN
ajst-32394	81	5	and	and	CCONJ
ajst-32394	81	6	the	the	DET
ajst-32394	81	7	implementation	implementation	NOUN
ajst-32394	81	8	of	of	ADP
ajst-32394	81	9	explainable	explainable	ADJ
ajst-32394	81	10	artificial	artificial	ADJ
ajst-32394	81	11	intelligence	intelligence	NOUN
ajst-32394	81	12	(	(	PUNCT
ajst-32394	81	13	xai	xai	PROPN
ajst-32394	81	14	)	)	PUNCT
ajst-32394	81	15	tools	tool	NOUN
ajst-32394	81	16	,	,	PUNCT
ajst-32394	81	17	machine	machine	NOUN
ajst-32394	81	18	learning	learn	VERB
ajst-32394	81	19	not	not	PART
ajst-32394	81	20	only	only	ADV
ajst-32394	81	21	augments	augment	VERB
ajst-32394	81	22	evidence	evidence	NOUN
ajst-32394	81	23	-	-	PUNCT
ajst-32394	81	24	based	base	VERB
ajst-32394	81	25	decision	decision	NOUN
ajst-32394	81	26	-	-	PUNCT
ajst-32394	81	27	making	making	NOUN
ajst-32394	81	28	but	but	CCONJ
ajst-32394	81	29	also	also	ADV
ajst-32394	81	30	fosters	foster	VERB
ajst-32394	81	31	the	the	DET
ajst-32394	81	32	evolution	evolution	NOUN
ajst-32394	81	33	of	of	ADP
ajst-32394	81	34	toxicology	toxicology	NOUN
ajst-32394	81	35	towards	towards	ADP
ajst-32394	81	36	a	a	DET
ajst-32394	81	37	more	more	ADV
ajst-32394	81	38	open	open	ADJ
ajst-32394	81	39	and	and	CCONJ
ajst-32394	81	40	collaborative	collaborative	ADJ
ajst-32394	81	41	paradigm	paradigm	NOUN
ajst-32394	81	42	.	.	PUNCT
ajst-32394	82	1	this	this	DET
ajst-32394	82	2	evolution	evolution	NOUN
ajst-32394	82	3	leverages	leverage	VERB
ajst-32394	82	4	public	public	ADJ
ajst-32394	82	5	datasets	dataset	NOUN
ajst-32394	82	6	and	and	CCONJ
ajst-32394	82	7	cooperative	cooperative	ADJ
ajst-32394	82	8	models	model	NOUN
ajst-32394	82	9	to	to	PART
ajst-32394	82	10	contribute	contribute	VERB
ajst-32394	82	11	to	to	ADP
ajst-32394	82	12	a	a	DET
ajst-32394	82	13	safer	safe	ADJ
ajst-32394	82	14	chemical	chemical	NOUN
ajst-32394	82	15	future	future	NOUN
ajst-32394	82	16	.	.	PUNCT
ajst-32394	83	1	4	4	X
ajst-32394	83	2	.	.	X
ajst-32394	83	3	machine	machine	NOUN
ajst-32394	83	4	learning	learn	VERB
ajst-32394	83	5	approaches	approach	NOUN
ajst-32394	83	6	to	to	ADP
ajst-32394	83	7	toxicological	toxicological	ADJ
ajst-32394	83	8	data	datum	NOUN
ajst-32394	83	9	analysis	analysis	NOUN
ajst-32394	83	10	machine	machine	NOUN
ajst-32394	83	11	learning	learning	NOUN
ajst-32394	83	12	provides	provide	VERB
ajst-32394	83	13	a	a	DET
ajst-32394	83	14	robust	robust	ADJ
ajst-32394	83	15	methodological	methodological	ADJ
ajst-32394	83	16	framework	framework	NOUN
ajst-32394	83	17	for	for	ADP
ajst-32394	83	18	the	the	DET
ajst-32394	83	19	analysis	analysis	NOUN
ajst-32394	83	20	of	of	ADP
ajst-32394	83	21	toxicological	toxicological	ADJ
ajst-32394	83	22	data	datum	NOUN
ajst-32394	83	23	,	,	PUNCT
ajst-32394	83	24	allowing	allow	VERB
ajst-32394	83	25	for	for	ADP
ajst-32394	83	26	the	the	DET
ajst-32394	83	27	effective	effective	ADJ
ajst-32394	83	28	processing	processing	NOUN
ajst-32394	83	29	of	of	ADP
ajst-32394	83	30	high	high	ADJ
ajst-32394	83	31	-	-	PUNCT
ajst-32394	83	32	dimensional	dimensional	ADJ
ajst-32394	83	33	and	and	CCONJ
ajst-32394	83	34	complex	complex	ADJ
ajst-32394	83	35	datasets	dataset	NOUN
ajst-32394	83	36	,	,	PUNCT
ajst-32394	83	37	including	include	VERB
ajst-32394	83	38	gene	gene	NOUN
ajst-32394	83	39	expression	expression	NOUN
ajst-32394	83	40	,	,	PUNCT
ajst-32394	83	41	metabolomics	metabolomic	NOUN
ajst-32394	83	42	,	,	PUNCT
ajst-32394	83	43	and	and	CCONJ
ajst-32394	83	44	imaging	imaging	NOUN
ajst-32394	83	45	data	datum	NOUN
ajst-32394	83	46	.	.	PUNCT
ajst-32394	84	1	this	this	DET
ajst-32394	84	2	capability	capability	NOUN
ajst-32394	84	3	facilitates	facilitate	VERB
ajst-32394	84	4	the	the	DET
ajst-32394	84	5	elucidation	elucidation	NOUN
ajst-32394	84	6	of	of	ADP
ajst-32394	84	7	toxicity	toxicity	NOUN
ajst-32394	84	8	205	205	NUM
ajst-32394	84	9	mechanisms	mechanism	NOUN
ajst-32394	84	10	and	and	CCONJ
ajst-32394	84	11	the	the	DET
ajst-32394	84	12	prediction	prediction	NOUN
ajst-32394	84	13	of	of	ADP
ajst-32394	84	14	toxicological	toxicological	ADJ
ajst-32394	84	15	outcomes	outcome	NOUN
ajst-32394	84	16	[	[	X
ajst-32394	84	17	19	19	NUM
ajst-32394	84	18	-	-	SYM
ajst-32394	84	19	21	21	NUM
ajst-32394	84	20	]	]	PUNCT
ajst-32394	84	21	.	.	PUNCT
ajst-32394	85	1	in	in	ADP
ajst-32394	85	2	the	the	DET
ajst-32394	85	3	contemporary	contemporary	ADJ
ajst-32394	85	4	context	context	NOUN
ajst-32394	85	5	,	,	PUNCT
ajst-32394	85	6	where	where	SCONJ
ajst-32394	85	7	omics	omic	NOUN
ajst-32394	85	8	data	datum	NOUN
ajst-32394	85	9	increasingly	increasingly	ADV
ajst-32394	85	10	surpass	surpass	VERB
ajst-32394	85	11	traditional	traditional	ADJ
ajst-32394	85	12	toxicological	toxicological	ADJ
ajst-32394	85	13	endpoints	endpoint	NOUN
ajst-32394	85	14	,	,	PUNCT
ajst-32394	85	15	the	the	DET
ajst-32394	85	16	advantages	advantage	NOUN
ajst-32394	85	17	of	of	ADP
ajst-32394	85	18	machine	machine	NOUN
ajst-32394	85	19	learning	learning	NOUN
ajst-32394	85	20	are	be	AUX
ajst-32394	85	21	predominantly	predominantly	ADV
ajst-32394	85	22	evident	evident	ADJ
ajst-32394	85	23	in	in	ADP
ajst-32394	85	24	its	its	PRON
ajst-32394	85	25	capacity	capacity	NOUN
ajst-32394	85	26	for	for	ADP
ajst-32394	85	27	dimensionality	dimensionality	NOUN
ajst-32394	85	28	reduction	reduction	NOUN
ajst-32394	85	29	,	,	PUNCT
ajst-32394	85	30	pattern	pattern	NOUN
ajst-32394	85	31	recognition	recognition	NOUN
ajst-32394	85	32	,	,	PUNCT
ajst-32394	85	33	and	and	CCONJ
ajst-32394	85	34	predictive	predictive	ADJ
ajst-32394	85	35	integration	integration	NOUN
ajst-32394	85	36	.	.	PUNCT
ajst-32394	86	1	this	this	DET
ajst-32394	86	2	approach	approach	NOUN
ajst-32394	86	3	not	not	PART
ajst-32394	86	4	only	only	ADV
ajst-32394	86	5	addresses	address	VERB
ajst-32394	86	6	the	the	DET
ajst-32394	86	7	data	data	NOUN
ajst-32394	86	8	challenges	challenge	NOUN
ajst-32394	86	9	historically	historically	ADV
ajst-32394	86	10	encountered	encounter	VERB
ajst-32394	86	11	in	in	ADP
ajst-32394	86	12	toxicology	toxicology	NOUN
ajst-32394	86	13	research	research	NOUN
ajst-32394	86	14	but	but	CCONJ
ajst-32394	86	15	also	also	ADV
ajst-32394	86	16	aligns	align	VERB
ajst-32394	86	17	with	with	ADP
ajst-32394	86	18	the	the	DET
ajst-32394	86	19	human	human	NOUN
ajst-32394	86	20	-	-	PUNCT
ajst-32394	86	21	centric	centric	ADJ
ajst-32394	86	22	,	,	PUNCT
ajst-32394	86	23	pathway	pathway	NOUN
ajst-32394	86	24	-	-	PUNCT
ajst-32394	86	25	oriented	orient	VERB
ajst-32394	86	26	assessment	assessment	NOUN
ajst-32394	86	27	paradigm	paradigm	NOUN
ajst-32394	86	28	proposed	propose	VERB
ajst-32394	86	29	by	by	ADP
ajst-32394	86	30	the	the	DET
ajst-32394	86	31	u.s	u.s	PROPN
ajst-32394	86	32	.	.	PROPN
ajst-32394	86	33	national	national	PROPN
ajst-32394	86	34	academy	academy	PROPN
ajst-32394	86	35	of	of	ADP
ajst-32394	86	36	sciences	sciences	PROPN
ajst-32394	86	37	.	.	PUNCT
ajst-32394	87	1	the	the	DET
ajst-32394	87	2	enanomapper	enanomapper	NOUN
ajst-32394	87	3	platform	platform	NOUN
ajst-32394	87	4	epitomizes	epitomize	VERB
ajst-32394	87	5	ml	ml	NOUN
ajst-32394	87	6	's	's	PART
ajst-32394	87	7	utility	utility	NOUN
ajst-32394	87	8	in	in	ADP
ajst-32394	87	9	nanomaterial	nanomaterial	ADJ
ajst-32394	87	10	analytics	analytic	NOUN
ajst-32394	87	11	,	,	PUNCT
ajst-32394	87	12	proffering	proffer	VERB
ajst-32394	87	13	an	an	DET
ajst-32394	87	14	api	api	NOUN
ajst-32394	87	15	conduit	conduit	NOUN
ajst-32394	87	16	for	for	ADP
ajst-32394	87	17	bespoke	bespoke	NOUN
ajst-32394	87	18	data	datum	NOUN
ajst-32394	87	19	retrieval	retrieval	NOUN
ajst-32394	87	20	and	and	CCONJ
ajst-32394	87	21	preprocessing	preprocessing	NOUN
ajst-32394	87	22	,	,	PUNCT
ajst-32394	87	23	thereby	thereby	ADV
ajst-32394	87	24	enabling	enable	VERB
ajst-32394	87	25	reproducible	reproducible	ADJ
ajst-32394	87	26	nanoqsar	nanoqsar	NOUN
ajst-32394	87	27	derivations	derivation	NOUN
ajst-32394	87	28	[	[	X
ajst-32394	87	29	22	22	NUM
ajst-32394	87	30	]	]	PUNCT
ajst-32394	87	31	.	.	PUNCT
ajst-32394	88	1	by	by	ADP
ajst-32394	88	2	ingesting	ingest	VERB
ajst-32394	88	3	physicochemical	physicochemical	ADJ
ajst-32394	88	4	attributes	attribute	NOUN
ajst-32394	88	5	—	—	PUNCT
ajst-32394	88	6	particle	particle	NOUN
ajst-32394	88	7	size	size	NOUN
ajst-32394	88	8	,	,	PUNCT
ajst-32394	88	9	zeta	zeta	NOUN
ajst-32394	88	10	potential	potential	NOUN
ajst-32394	88	11	,	,	PUNCT
ajst-32394	88	12	surface	surface	NOUN
ajst-32394	88	13	coatings	coating	NOUN
ajst-32394	88	14	—	—	PUNCT
ajst-32394	88	15	alongside	alongside	ADP
ajst-32394	88	16	bioassay	bioassay	NOUN
ajst-32394	88	17	readouts	readout	NOUN
ajst-32394	88	18	,	,	PUNCT
ajst-32394	88	19	ml	ml	ADP
ajst-32394	88	20	algorithms	algorithm	NOUN
ajst-32394	88	21	like	like	ADP
ajst-32394	88	22	elastic	elastic	ADJ
ajst-32394	88	23	nets	net	NOUN
ajst-32394	88	24	or	or	CCONJ
ajst-32394	88	25	deep	deep	ADJ
ajst-32394	88	26	neural	neural	ADJ
ajst-32394	88	27	nets	net	NOUN
ajst-32394	88	28	forge	forge	ADJ
ajst-32394	88	29	predictive	predictive	ADJ
ajst-32394	88	30	manifolds	manifold	NOUN
ajst-32394	88	31	for	for	ADP
ajst-32394	88	32	cytotoxicity	cytotoxicity	NOUN
ajst-32394	88	33	or	or	CCONJ
ajst-32394	88	34	genotoxicity	genotoxicity	NOUN
ajst-32394	88	35	,	,	PUNCT
ajst-32394	88	36	attaining	attain	VERB
ajst-32394	88	37	roc	roc	NOUN
ajst-32394	88	38	-	-	PUNCT
ajst-32394	88	39	aucs	aucs	NOUN
ajst-32394	88	40	above	above	ADP
ajst-32394	88	41	0.85	0.85	NUM
ajst-32394	88	42	in	in	ADP
ajst-32394	88	43	crossvalidation	crossvalidation	NOUN
ajst-32394	88	44	.	.	PUNCT
ajst-32394	89	1	as	as	SCONJ
ajst-32394	89	2	highlighted	highlight	VERB
ajst-32394	89	3	in	in	ADP
ajst-32394	89	4	recent	recent	ADJ
ajst-32394	89	5	deep	deep	ADJ
ajst-32394	89	6	learning	learning	NOUN
ajst-32394	89	7	paradigms	paradigm	NOUN
ajst-32394	89	8	,	,	PUNCT
ajst-32394	89	9	transformer	transformer	NOUN
ajst-32394	89	10	architectures	architecture	NOUN
ajst-32394	89	11	now	now	ADV
ajst-32394	89	12	autoencode	autoencode	VERB
ajst-32394	89	13	nanomaterial	nanomaterial	ADJ
ajst-32394	89	14	graphs	graph	NOUN
ajst-32394	89	15	,	,	PUNCT
ajst-32394	89	16	surpassing	surpass	VERB
ajst-32394	89	17	classical	classical	ADJ
ajst-32394	89	18	qsar	qsar	NOUN
ajst-32394	89	19	by	by	ADP
ajst-32394	89	20	capturing	capture	VERB
ajst-32394	89	21	agglomeration	agglomeration	NOUN
ajst-32394	89	22	dynamics	dynamic	NOUN
ajst-32394	89	23	and	and	CCONJ
ajst-32394	89	24	corona	corona	NOUN
ajst-32394	89	25	formations	formation	NOUN
ajst-32394	89	26	,	,	PUNCT
ajst-32394	89	27	critical	critical	ADJ
ajst-32394	89	28	for	for	ADP
ajst-32394	89	29	dermal	dermal	ADJ
ajst-32394	89	30	penetration	penetration	NOUN
ajst-32394	89	31	forecasts	forecast	NOUN
ajst-32394	89	32	[	[	X
ajst-32394	89	33	23	23	NUM
ajst-32394	89	34	]	]	PUNCT
ajst-32394	89	35	.	.	PUNCT
ajst-32394	90	1	metabolomics	metabolomic	NOUN
ajst-32394	90	2	and	and	CCONJ
ajst-32394	90	3	lipidomics	lipidomic	NOUN
ajst-32394	90	4	integration	integration	NOUN
ajst-32394	90	5	via	via	ADP
ajst-32394	90	6	ml	ml	PROPN
ajst-32394	90	7	unveils	unveil	VERB
ajst-32394	90	8	dose	dose	NOUN
ajst-32394	90	9	-	-	PUNCT
ajst-32394	90	10	response	response	NOUN
ajst-32394	90	11	topographies	topography	NOUN
ajst-32394	90	12	,	,	PUNCT
ajst-32394	90	13	correlating	correlate	VERB
ajst-32394	90	14	spectral	spectral	ADJ
ajst-32394	90	15	signatures	signature	NOUN
ajst-32394	90	16	to	to	ADP
ajst-32394	90	17	classical	classical	ADJ
ajst-32394	90	18	endpoints	endpoint	NOUN
ajst-32394	90	19	like	like	ADP
ajst-32394	90	20	ast	ast	NOUN
ajst-32394	90	21	elevations	elevation	NOUN
ajst-32394	90	22	.	.	PUNCT
ajst-32394	91	1	multivariate	multivariate	NOUN
ajst-32394	91	2	fusion	fusion	NOUN
ajst-32394	91	3	of	of	ADP
ajst-32394	91	4	nine	nine	NUM
ajst-32394	91	5	datasets	dataset	NOUN
ajst-32394	91	6	—	—	PUNCT
ajst-32394	91	7	encompassing	encompass	VERB
ajst-32394	91	8	direct	direct	ADJ
ajst-32394	91	9	infusion	infusion	NOUN
ajst-32394	91	10	ms	ms	NOUN
ajst-32394	91	11	for	for	ADP
ajst-32394	91	12	lipids	lipid	NOUN
ajst-32394	91	13	—	—	PUNCT
ajst-32394	91	14	identifies	identify	VERB
ajst-32394	91	15	lipidomic	lipidomic	ADJ
ajst-32394	91	16	perturbations	perturbation	NOUN
ajst-32394	91	17	as	as	ADP
ajst-32394	91	18	premier	premier	ADJ
ajst-32394	91	19	harbingers	harbinger	NOUN
ajst-32394	91	20	of	of	ADP
ajst-32394	91	21	hepatic	hepatic	ADJ
ajst-32394	91	22	insult	insult	NOUN
ajst-32394	91	23	,	,	PUNCT
ajst-32394	91	24	with	with	ADP
ajst-32394	91	25	random	random	ADJ
ajst-32394	91	26	forests	forest	NOUN
ajst-32394	91	27	establishing	establish	VERB
ajst-32394	91	28	causal	causal	ADJ
ajst-32394	91	29	arcs	arcs	NOUN
ajst-32394	91	30	from	from	ADP
ajst-32394	91	31	phospholipid	phospholipid	NOUN
ajst-32394	91	32	asymmetry	asymmetry	NOUN
ajst-32394	91	33	to	to	ADP
ajst-32394	91	34	fibrosis	fibrosis	NOUN
ajst-32394	91	35	progression	progression	NOUN
ajst-32394	91	36	[	[	X
ajst-32394	91	37	24	24	NUM
ajst-32394	91	38	]	]	PUNCT
ajst-32394	91	39	.	.	PUNCT
ajst-32394	92	1	contemporary	contemporary	ADJ
ajst-32394	92	2	extensions	extension	NOUN
ajst-32394	92	3	,	,	PUNCT
ajst-32394	92	4	drawing	draw	VERB
ajst-32394	92	5	from	from	ADP
ajst-32394	92	6	frontiers	frontier	NOUN
ajst-32394	92	7	'	'	PART
ajst-32394	92	8	2024	2024	NUM
ajst-32394	92	9	discourse	discourse	NOUN
ajst-32394	92	10	,	,	PUNCT
ajst-32394	92	11	deploy	deploy	VERB
ajst-32394	92	12	hidden	hidden	ADJ
ajst-32394	92	13	markov	markov	NOUN
ajst-32394	92	14	models	model	NOUN
ajst-32394	92	15	on	on	ADP
ajst-32394	92	16	toxicometabolomes	toxicometabolome	NOUN
ajst-32394	92	17	to	to	PART
ajst-32394	92	18	infer	infer	VERB
ajst-32394	92	19	pathobiology	pathobiology	NOUN
ajst-32394	92	20	stages	stage	NOUN
ajst-32394	92	21	,	,	PUNCT
ajst-32394	92	22	unmasking	unmask	VERB
ajst-32394	92	23	latent	latent	ADJ
ajst-32394	92	24	transitions	transition	NOUN
ajst-32394	92	25	in	in	ADP
ajst-32394	92	26	xenobiotic	xenobiotic	ADJ
ajst-32394	92	27	catabolism	catabolism	NOUN
ajst-32394	92	28	that	that	PRON
ajst-32394	92	29	rule	rule	NOUN
ajst-32394	92	30	-	-	PUNCT
ajst-32394	92	31	based	base	VERB
ajst-32394	92	32	heuristics	heuristic	NOUN
ajst-32394	92	33	overlook	overlook	VERB
ajst-32394	92	34	[	[	X
ajst-32394	92	35	25	25	NUM
ajst-32394	92	36	]	]	PUNCT
ajst-32394	92	37	.	.	PUNCT
ajst-32394	93	1	high	high	ADJ
ajst-32394	93	2	-	-	PUNCT
ajst-32394	93	3	content	content	NOUN
ajst-32394	93	4	screening	screening	NOUN
ajst-32394	93	5	(	(	PUNCT
ajst-32394	93	6	hcs	hcs	PROPN
ajst-32394	93	7	)	)	PUNCT
ajst-32394	93	8	data	datum	NOUN
ajst-32394	93	9	,	,	PUNCT
ajst-32394	93	10	burgeoning	burgeon	VERB
ajst-32394	93	11	with	with	ADP
ajst-32394	93	12	multiparametric	multiparametric	ADJ
ajst-32394	93	13	cellular	cellular	ADJ
ajst-32394	93	14	vignettes	vignette	NOUN
ajst-32394	93	15	,	,	PUNCT
ajst-32394	93	16	benefits	benefit	VERB
ajst-32394	93	17	immensely	immensely	ADV
ajst-32394	93	18	from	from	ADP
ajst-32394	93	19	ml	ml	ADV
ajst-32394	93	20	-	-	PUNCT
ajst-32394	93	21	driven	drive	VERB
ajst-32394	93	22	image	image	NOUN
ajst-32394	93	23	informatics	informatic	NOUN
ajst-32394	93	24	.	.	PUNCT
ajst-32394	94	1	automated	automate	VERB
ajst-32394	94	2	segmentation	segmentation	NOUN
ajst-32394	94	3	and	and	CCONJ
ajst-32394	94	4	phenoclustering	phenoclustering	NOUN
ajst-32394	94	5	—	—	PUNCT
ajst-32394	94	6	via	via	ADP
ajst-32394	94	7	convolutional	convolutional	ADJ
ajst-32394	94	8	nets	net	NOUN
ajst-32394	94	9	or	or	CCONJ
ajst-32394	94	10	u	u	ADJ
ajst-32394	94	11	-	-	ADJ
ajst-32394	94	12	net	net	ADJ
ajst-32394	94	13	variants	variant	NOUN
ajst-32394	94	14	—	—	PUNCT
ajst-32394	94	15	quantify	quantify	VERB
ajst-32394	94	16	morphological	morphological	ADJ
ajst-32394	94	17	aberrations	aberration	NOUN
ajst-32394	94	18	,	,	PUNCT
ajst-32394	94	19	such	such	ADJ
ajst-32394	94	20	as	as	ADP
ajst-32394	94	21	mitochondrial	mitochondrial	ADJ
ajst-32394	94	22	fragmentation	fragmentation	NOUN
ajst-32394	94	23	or	or	CCONJ
ajst-32394	94	24	lysosomal	lysosomal	ADJ
ajst-32394	94	25	engorgement	engorgement	NOUN
ajst-32394	94	26	,	,	PUNCT
ajst-32394	94	27	post	post	ADJ
ajst-32394	94	28	-	-	ADJ
ajst-32394	94	29	compound	compound	ADJ
ajst-32394	94	30	insult	insult	NOUN
ajst-32394	94	31	,	,	PUNCT
ajst-32394	94	32	facilitating	facilitate	VERB
ajst-32394	94	33	toxicity	toxicity	NOUN
ajst-32394	94	34	tiering	tiere	VERB
ajst-32394	94	35	with	with	ADP
ajst-32394	94	36	precisions	precision	NOUN
ajst-32394	94	37	exceeding	exceed	VERB
ajst-32394	94	38	90	90	NUM
ajst-32394	94	39	%	%	NOUN
ajst-32394	94	40	[	[	X
ajst-32394	94	41	26	26	NUM
ajst-32394	94	42	]	]	PUNCT
ajst-32394	94	43	.	.	PUNCT
ajst-32394	95	1	in	in	ADP
ajst-32394	95	2	2025	2025	NUM
ajst-32394	95	3	,	,	PUNCT
ajst-32394	95	4	interpretable	interpretable	ADJ
ajst-32394	95	5	variants	variant	NOUN
ajst-32394	95	6	like	like	ADP
ajst-32394	95	7	tabnet	tabnet	NOUN
ajst-32394	95	8	furnish	furnish	PROPN
ajst-32394	95	9	shap	shap	PROPN
ajst-32394	95	10	attributions	attribution	NOUN
ajst-32394	95	11	,	,	PUNCT
ajst-32394	95	12	demystifying	demystify	VERB
ajst-32394	95	13	convolutional	convolutional	ADJ
ajst-32394	95	14	decisions	decision	NOUN
ajst-32394	95	15	to	to	PART
ajst-32394	95	16	reveal	reveal	VERB
ajst-32394	95	17	substructural	substructural	ADJ
ajst-32394	95	18	alerts	alert	NOUN
ajst-32394	95	19	,	,	PUNCT
ajst-32394	95	20	thus	thus	ADV
ajst-32394	95	21	bridging	bridge	VERB
ajst-32394	95	22	phenotypic	phenotypic	ADJ
ajst-32394	95	23	readouts	readout	NOUN
ajst-32394	95	24	to	to	ADP
ajst-32394	95	25	molecular	molecular	ADJ
ajst-32394	95	26	initiators	initiator	NOUN
ajst-32394	95	27	in	in	ADP
ajst-32394	95	28	aop	aop	PROPN
ajst-32394	95	29	frameworks	framework	NOUN
ajst-32394	95	30	[	[	X
ajst-32394	95	31	27	27	NUM
ajst-32394	95	32	,	,	PUNCT
ajst-32394	95	33	28	28	NUM
ajst-32394	95	34	]	]	PUNCT
ajst-32394	95	35	.	.	PUNCT
ajst-32394	96	1	5	5	X
ajst-32394	96	2	.	.	X
ajst-32394	96	3	identifying	identify	VERB
ajst-32394	96	4	toxicant	toxicant	NOUN
ajst-32394	96	5	-	-	PUNCT
ajst-32394	96	6	induced	induce	VERB
ajst-32394	96	7	pathways	pathway	NOUN
ajst-32394	96	8	with	with	ADP
ajst-32394	96	9	machine	machine	NOUN
ajst-32394	96	10	learning	learn	VERB
ajst-32394	96	11	ml	ml	AUX
ajst-32394	96	12	is	be	AUX
ajst-32394	96	13	indispensable	indispensable	ADJ
ajst-32394	96	14	for	for	ADP
ajst-32394	96	15	decoding	decode	VERB
ajst-32394	96	16	pathways	pathway	NOUN
ajst-32394	96	17	triggered	trigger	VERB
ajst-32394	96	18	by	by	ADP
ajst-32394	96	19	toxicants	toxicant	NOUN
ajst-32394	96	20	,	,	PUNCT
ajst-32394	96	21	as	as	SCONJ
ajst-32394	96	22	it	it	PRON
ajst-32394	96	23	dissects	dissect	VERB
ajst-32394	96	24	vast	vast	ADJ
ajst-32394	96	25	omics	omic	NOUN
ajst-32394	96	26	datasets	dataset	NOUN
ajst-32394	96	27	to	to	PART
ajst-32394	96	28	trace	trace	VERB
ajst-32394	96	29	causal	causal	ADJ
ajst-32394	96	30	networks	network	NOUN
ajst-32394	96	31	that	that	PRON
ajst-32394	96	32	form	form	VERB
ajst-32394	96	33	the	the	DET
ajst-32394	96	34	basis	basis	NOUN
ajst-32394	96	35	of	of	ADP
ajst-32394	96	36	pathological	pathological	ADJ
ajst-32394	96	37	cascades	cascade	NOUN
ajst-32394	96	38	[	[	PUNCT
ajst-32394	96	39	29	29	NUM
ajst-32394	96	40	-	-	SYM
ajst-32394	96	41	31	31	NUM
ajst-32394	96	42	]	]	PUNCT
ajst-32394	96	43	.	.	PUNCT
ajst-32394	97	1	by	by	ADP
ajst-32394	97	2	surmounting	surmount	VERB
ajst-32394	97	3	the	the	DET
ajst-32394	97	4	opacity	opacity	NOUN
ajst-32394	97	5	of	of	ADP
ajst-32394	97	6	traditional	traditional	ADJ
ajst-32394	97	7	biochemistry	biochemistry	NOUN
ajst-32394	97	8	,	,	PUNCT
ajst-32394	97	9	ml	ml	ADP
ajst-32394	97	10	algorithms	algorithm	NOUN
ajst-32394	97	11	—	—	PUNCT
ajst-32394	97	12	ranging	range	VERB
ajst-32394	97	13	from	from	ADP
ajst-32394	97	14	clustering	cluster	VERB
ajst-32394	97	15	to	to	ADP
ajst-32394	97	16	graph	graph	VERB
ajst-32394	97	17	neural	neural	ADJ
ajst-32394	97	18	networks	network	NOUN
ajst-32394	97	19	—	—	PUNCT
ajst-32394	97	20	illuminate	illuminate	VERB
ajst-32394	97	21	latent	latent	NOUN
ajst-32394	97	22	interactions	interaction	NOUN
ajst-32394	97	23	,	,	PUNCT
ajst-32394	97	24	fostering	foster	VERB
ajst-32394	97	25	a	a	DET
ajst-32394	97	26	granular	granular	ADJ
ajst-32394	97	27	comprehension	comprehension	NOUN
ajst-32394	97	28	of	of	ADP
ajst-32394	97	29	toxicity	toxicity	NOUN
ajst-32394	97	30	propagation	propagation	NOUN
ajst-32394	97	31	from	from	ADP
ajst-32394	97	32	molecular	molecular	ADJ
ajst-32394	97	33	perturbations	perturbation	NOUN
ajst-32394	97	34	to	to	ADP
ajst-32394	97	35	organismal	organismal	ADJ
ajst-32394	97	36	detriment	detriment	NOUN
ajst-32394	97	37	,	,	PUNCT
ajst-32394	97	38	as	as	SCONJ
ajst-32394	97	39	emphasized	emphasize	VERB
ajst-32394	97	40	in	in	ADP
ajst-32394	97	41	recent	recent	ADJ
ajst-32394	97	42	2025	2025	NUM
ajst-32394	97	43	reviews	review	NOUN
ajst-32394	97	44	on	on	ADP
ajst-32394	97	45	aidriven	aidriven	ADJ
ajst-32394	97	46	predictive	predictive	ADJ
ajst-32394	97	47	toxicology	toxicology	NOUN
ajst-32394	97	48	.	.	PUNCT
ajst-32394	98	1	analogously	analogously	ADV
ajst-32394	98	2	,	,	PUNCT
ajst-32394	98	3	in	in	ADP
ajst-32394	98	4	multiple	multiple	ADJ
ajst-32394	98	5	myeloma	myeloma	NOUN
ajst-32394	98	6	(	(	PUNCT
ajst-32394	98	7	mm	mm	PROPN
ajst-32394	98	8	)	)	PUNCT
ajst-32394	98	9	,	,	PUNCT
ajst-32394	98	10	ml	ml	AUX
ajst-32394	98	11	dissects	dissect	VERB
ajst-32394	98	12	glycosyltransferase	glycosyltransferase	NOUN
ajst-32394	98	13	(	(	PUNCT
ajst-32394	98	14	gt)-related	gt)-relate	VERB
ajst-32394	98	15	biomarkers	biomarker	NOUN
ajst-32394	98	16	,	,	PUNCT
ajst-32394	98	17	pivotal	pivotal	ADJ
ajst-32394	98	18	to	to	ADP
ajst-32394	98	19	glycan	glycan	NOUN
ajst-32394	98	20	-	-	PUNCT
ajst-32394	98	21	mediated	mediate	VERB
ajst-32394	98	22	tumor	tumor	NOUN
ajst-32394	98	23	evasion	evasion	NOUN
ajst-32394	98	24	.	.	PUNCT
ajst-32394	99	1	from	from	ADP
ajst-32394	99	2	mmrf	mmrf	ADJ
ajst-32394	99	3	-	-	PUNCT
ajst-32394	99	4	commpass	commpass	NOUN
ajst-32394	99	5	and	and	CCONJ
ajst-32394	99	6	gse57317	gse57317	ADJ
ajst-32394	99	7	cohorts	cohort	NOUN
ajst-32394	99	8	,	,	PUNCT
ajst-32394	99	9	gt	gt	PROPN
ajst-32394	99	10	genes	gene	NOUN
ajst-32394	99	11	undergo	undergo	VERB
ajst-32394	99	12	cox	cox	NOUN
ajst-32394	99	13	-	-	PUNCT
ajst-32394	99	14	lasso	lasso	NOUN
ajst-32394	99	15	filtration	filtration	NOUN
ajst-32394	99	16	,	,	PUNCT
ajst-32394	99	17	yielding	yield	VERB
ajst-32394	99	18	a	a	DET
ajst-32394	99	19	gtpm	gtpm	NOUN
ajst-32394	99	20	via	via	ADP
ajst-32394	99	21	113	113	NUM
ajst-32394	99	22	algorithmic	algorithmic	ADJ
ajst-32394	99	23	permutations	permutation	NOUN
ajst-32394	99	24	—	—	PUNCT
ajst-32394	99	25	random	random	ADJ
ajst-32394	99	26	forests	forest	NOUN
ajst-32394	99	27	to	to	PART
ajst-32394	99	28	xgboost	xgboost	ADV
ajst-32394	99	29	—	—	PUNCT
ajst-32394	99	30	stratifying	stratify	VERB
ajst-32394	99	31	mm	mm	NOUN
ajst-32394	99	32	into	into	ADP
ajst-32394	99	33	high	high	ADJ
ajst-32394	99	34	/	/	SYM
ajst-32394	99	35	low	low	ADJ
ajst-32394	99	36	-	-	PUNCT
ajst-32394	99	37	risk	risk	NOUN
ajst-32394	99	38	echelons	echelon	NOUN
ajst-32394	99	39	with	with	ADP
ajst-32394	99	40	divergent	divergent	ADJ
ajst-32394	99	41	survivals	survival	NOUN
ajst-32394	99	42	[	[	X
ajst-32394	99	43	32	32	NUM
ajst-32394	99	44	]	]	PUNCT
ajst-32394	99	45	.	.	PUNCT
ajst-32394	100	1	b4galt3	b4galt3	NOUN
ajst-32394	100	2	emerges	emerge	VERB
ajst-32394	100	3	as	as	ADP
ajst-32394	100	4	a	a	DET
ajst-32394	100	5	linchpin	linchpin	NOUN
ajst-32394	100	6	,	,	PUNCT
ajst-32394	100	7	experimentally	experimentally	ADV
ajst-32394	100	8	validated	validate	VERB
ajst-32394	100	9	to	to	PART
ajst-32394	100	10	orchestrate	orchestrate	VERB
ajst-32394	100	11	mm	mm	NOUN
ajst-32394	100	12	proliferation	proliferation	NOUN
ajst-32394	100	13	via	via	ADP
ajst-32394	100	14	wnt	wnt	PROPN
ajst-32394	100	15	/	/	SYM
ajst-32394	100	16	β	β	NOUN
ajst-32394	100	17	-	-	ADJ
ajst-32394	100	18	catenin	catenin	ADJ
ajst-32394	100	19	/	/	SYM
ajst-32394	100	20	grp78	grp78	NOUN
ajst-32394	100	21	axis	axis	NOUN
ajst-32394	100	22	modulation	modulation	NOUN
ajst-32394	100	23	,	,	PUNCT
ajst-32394	100	24	fostering	foster	VERB
ajst-32394	100	25	endoplasmic	endoplasmic	ADJ
ajst-32394	100	26	reticulum	reticulum	NOUN
ajst-32394	100	27	stress	stress	NOUN
ajst-32394	100	28	and	and	CCONJ
ajst-32394	100	29	adhesion	adhesion	NOUN
ajst-32394	100	30	deficits	deficit	NOUN
ajst-32394	100	31	.	.	PUNCT
ajst-32394	101	1	2025	2025	NUM
ajst-32394	101	2	quantum	quantum	NOUN
ajst-32394	101	3	ml	ml	NOUN
ajst-32394	101	4	frameworks	framework	NOUN
ajst-32394	101	5	further	far	ADV
ajst-32394	101	6	amplify	amplify	VERB
ajst-32394	101	7	this	this	PRON
ajst-32394	101	8	,	,	PUNCT
ajst-32394	101	9	leveraging	leverage	VERB
ajst-32394	101	10	proteomic	proteomic	ADJ
ajst-32394	101	11	inputs	input	NOUN
ajst-32394	101	12	to	to	PART
ajst-32394	101	13	predict	predict	VERB
ajst-32394	101	14	drug	drug	NOUN
ajst-32394	101	15	sensitivities	sensitivity	NOUN
ajst-32394	101	16	,	,	PUNCT
ajst-32394	101	17	unmasking	unmask	VERB
ajst-32394	101	18	gt	gt	PROPN
ajst-32394	101	19	hubs	hub	NOUN
ajst-32394	101	20	as	as	ADP
ajst-32394	101	21	venetoclax	venetoclax	NOUN
ajst-32394	101	22	synergizers	synergizer	NOUN
ajst-32394	101	23	in	in	ADP
ajst-32394	101	24	relapsed	relapse	VERB
ajst-32394	101	25	cohorts	cohort	NOUN
ajst-32394	101	26	[	[	X
ajst-32394	101	27	33	33	NUM
ajst-32394	101	28	]	]	PUNCT
ajst-32394	101	29	.	.	PUNCT
ajst-32394	102	1	such	such	ADJ
ajst-32394	102	2	insights	insight	NOUN
ajst-32394	102	3	propel	propel	VERB
ajst-32394	102	4	gt	gt	PROPN
ajst-32394	102	5	inhibitors	inhibitor	NOUN
ajst-32394	102	6	toward	toward	ADP
ajst-32394	102	7	clinical	clinical	ADJ
ajst-32394	102	8	trials	trial	NOUN
ajst-32394	102	9	,	,	PUNCT
ajst-32394	102	10	targeting	target	VERB
ajst-32394	102	11	glyco	glyco	NOUN
ajst-32394	102	12	-	-	NOUN
ajst-32394	102	13	phenotypes	phenotypes	NOUN
ajst-32394	102	14	that	that	PRON
ajst-32394	102	15	toxicants	toxicant	NOUN
ajst-32394	102	16	like	like	ADP
ajst-32394	102	17	benzene	benzene	NOUN
ajst-32394	102	18	exacerbate	exacerbate	VERB
ajst-32394	102	19	.	.	PUNCT
ajst-32394	103	1	burn	burn	VERB
ajst-32394	103	2	sequelae	sequelae	ADJ
ajst-32394	103	3	,	,	PUNCT
ajst-32394	103	4	emblematic	emblematic	ADJ
ajst-32394	103	5	of	of	ADP
ajst-32394	103	6	acute	acute	ADJ
ajst-32394	103	7	toxicant	toxicant	ADJ
ajst-32394	103	8	insults	insult	NOUN
ajst-32394	103	9	,	,	PUNCT
ajst-32394	103	10	spotlight	spotlight	NOUN
ajst-32394	103	11	lactylation	lactylation	NOUN
ajst-32394	103	12	—	—	PUNCT
ajst-32394	103	13	a	a	DET
ajst-32394	103	14	lactate	lactate	NOUN
ajst-32394	103	15	-	-	PUNCT
ajst-32394	103	16	fueled	fuel	VERB
ajst-32394	103	17	histone	histone	NOUN
ajst-32394	103	18	modification	modification	NOUN
ajst-32394	103	19	—	—	PUNCT
ajst-32394	103	20	as	as	ADP
ajst-32394	103	21	an	an	DET
ajst-32394	103	22	inflammatory	inflammatory	ADJ
ajst-32394	103	23	fulcrum	fulcrum	NOUN
ajst-32394	103	24	.	.	PUNCT
ajst-32394	104	1	transcriptomic	transcriptomic	ADJ
ajst-32394	104	2	profiling	profiling	NOUN
ajst-32394	104	3	of	of	ADP
ajst-32394	104	4	burn	burn	NOUN
ajst-32394	104	5	victims	victim	NOUN
ajst-32394	104	6	reveals	reveal	VERB
ajst-32394	104	7	lactylation	lactylation	NOUN
ajst-32394	104	8	gene	gene	NOUN
ajst-32394	104	9	dysregulation	dysregulation	NOUN
ajst-32394	104	10	,	,	PUNCT
ajst-32394	104	11	with	with	ADP
ajst-32394	104	12	pathway	pathway	NOUN
ajst-32394	104	13	analyses	analyse	VERB
ajst-32394	104	14	flagging	flag	VERB
ajst-32394	104	15	rna	rna	NOUN
ajst-32394	104	16	splicing	splicing	NOUN
ajst-32394	104	17	and	and	CCONJ
ajst-32394	104	18	intercellular	intercellular	ADJ
ajst-32394	104	19	adhesion	adhesion	NOUN
ajst-32394	104	20	upheavals	upheaval	NOUN
ajst-32394	104	21	[	[	PUNCT
ajst-32394	104	22	34	34	NUM
ajst-32394	104	23	-	-	SYM
ajst-32394	104	24	36	36	NUM
ajst-32394	104	25	]	]	PUNCT
ajst-32394	104	26	.	.	PUNCT
ajst-32394	105	1	ml	ml	X
ajst-32394	105	2	—	—	PUNCT
ajst-32394	105	3	support	support	VERB
ajst-32394	105	4	vector	vector	NOUN
ajst-32394	105	5	machines	machine	NOUN
ajst-32394	105	6	and	and	CCONJ
ajst-32394	105	7	neural	neural	ADJ
ajst-32394	105	8	nets	net	NOUN
ajst-32394	105	9	—	—	PUNCT
ajst-32394	105	10	curates	curate	VERB
ajst-32394	105	11	four	four	NUM
ajst-32394	105	12	sentinels	sentinel	NOUN
ajst-32394	105	13	:	:	PUNCT
ajst-32394	105	14	206	206	NUM
ajst-32394	105	15	rpl14	rpl14	PROPN
ajst-32394	105	16	,	,	PUNCT
ajst-32394	105	17	set	set	NOUN
ajst-32394	105	18	,	,	PUNCT
ajst-32394	105	19	eno1	eno1	NOUN
ajst-32394	105	20	,	,	PUNCT
ajst-32394	105	21	ppp1cc	ppp1cc	NOUN
ajst-32394	105	22	,	,	PUNCT
ajst-32394	105	23	whose	whose	DET
ajst-32394	105	24	signatures	signature	NOUN
ajst-32394	105	25	forecast	forecast	VERB
ajst-32394	105	26	immune	immune	ADJ
ajst-32394	105	27	microenvironments	microenvironment	NOUN
ajst-32394	105	28	rife	rife	ADJ
ajst-32394	105	29	with	with	ADP
ajst-32394	105	30	th2	th2	PROPN
ajst-32394	105	31	skew	skew	ADJ
ajst-32394	105	32	and	and	CCONJ
ajst-32394	105	33	macrophage	macrophage	ADJ
ajst-32394	105	34	anergy	anergy	NOUN
ajst-32394	105	35	.	.	PUNCT
ajst-32394	106	1	6	6	X
ajst-32394	106	2	.	.	X
ajst-32394	106	3	machine	machine	NOUN
ajst-32394	106	4	learning	learning	NOUN
ajst-32394	106	5	in	in	ADP
ajst-32394	106	6	the	the	DET
ajst-32394	106	7	study	study	NOUN
ajst-32394	106	8	of	of	ADP
ajst-32394	106	9	toxicant	toxicant	ADJ
ajst-32394	106	10	-	-	PUNCT
ajst-32394	106	11	target	target	NOUN
ajst-32394	106	12	interactions	interaction	NOUN
ajst-32394	106	13	machine	machine	NOUN
ajst-32394	106	14	learning	learning	NOUN
ajst-32394	106	15	is	be	AUX
ajst-32394	106	16	increasingly	increasingly	ADV
ajst-32394	106	17	pivotal	pivotal	ADJ
ajst-32394	106	18	in	in	ADP
ajst-32394	106	19	decoding	decode	VERB
ajst-32394	106	20	toxicant	toxicant	ADJ
ajst-32394	106	21	-	-	PUNCT
ajst-32394	106	22	target	target	NOUN
ajst-32394	106	23	interactions	interaction	NOUN
ajst-32394	106	24	,	,	PUNCT
ajst-32394	106	25	furnishing	furnish	VERB
ajst-32394	106	26	computational	computational	ADJ
ajst-32394	106	27	scaffolds	scaffold	NOUN
ajst-32394	106	28	to	to	PART
ajst-32394	106	29	forecast	forecast	VERB
ajst-32394	106	30	binding	bind	VERB
ajst-32394	106	31	affinities	affinity	NOUN
ajst-32394	106	32	and	and	CCONJ
ajst-32394	106	33	molecular	molecular	ADJ
ajst-32394	106	34	dialogues	dialogue	NOUN
ajst-32394	106	35	that	that	PRON
ajst-32394	106	36	underpin	underpin	VERB
ajst-32394	106	37	toxicity	toxicity	NOUN
ajst-32394	106	38	mechanisms	mechanism	NOUN
ajst-32394	106	39	and	and	CCONJ
ajst-32394	106	40	therapeutic	therapeutic	ADJ
ajst-32394	106	41	countermeasures	countermeasure	NOUN
ajst-32394	106	42	.	.	PUNCT
ajst-32394	107	1	by	by	ADP
ajst-32394	107	2	surmounting	surmount	VERB
ajst-32394	107	3	the	the	DET
ajst-32394	107	4	logistical	logistical	ADJ
ajst-32394	107	5	encumbrances	encumbrance	NOUN
ajst-32394	107	6	of	of	ADP
ajst-32394	107	7	exhaustive	exhaustive	ADJ
ajst-32394	107	8	screening	screening	NOUN
ajst-32394	107	9	,	,	PUNCT
ajst-32394	107	10	ml	ml	ADP
ajst-32394	107	11	virtualizes	virtualizes	NOUN
ajst-32394	107	12	interaction	interaction	NOUN
ajst-32394	107	13	landscapes	landscape	NOUN
ajst-32394	107	14	,	,	PUNCT
ajst-32394	107	15	accelerating	accelerate	VERB
ajst-32394	107	16	hit	hit	VERB
ajst-32394	107	17	identification	identification	NOUN
ajst-32394	107	18	while	while	SCONJ
ajst-32394	107	19	illuminating	illuminate	VERB
ajst-32394	107	20	off	off	ADP
ajst-32394	107	21	-	-	PUNCT
ajst-32394	107	22	target	target	NOUN
ajst-32394	107	23	liabilities	liability	NOUN
ajst-32394	107	24	in	in	ADP
ajst-32394	107	25	a	a	DET
ajst-32394	107	26	chemical	chemical	NOUN
ajst-32394	107	27	exposome	exposome	NOUN
ajst-32394	107	28	teeming	teem	VERB
ajst-32394	107	29	with	with	ADP
ajst-32394	107	30	xenobiotics	xenobiotic	NOUN
ajst-32394	107	31	.	.	PUNCT
ajst-32394	108	1	this	this	DET
ajst-32394	108	2	paradigm	paradigm	NOUN
ajst-32394	108	3	,	,	PUNCT
ajst-32394	108	4	as	as	ADP
ajst-32394	108	5	recent	recent	ADJ
ajst-32394	108	6	2025	2025	NUM
ajst-32394	108	7	reviews	review	NOUN
ajst-32394	108	8	underscore	underscore	NOUN
ajst-32394	108	9	,	,	PUNCT
ajst-32394	108	10	leverages	leverage	VERB
ajst-32394	108	11	multimodal	multimodal	ADJ
ajst-32394	108	12	embedding	embed	VERB
ajst-32394	108	13	structural	structural	ADJ
ajst-32394	108	14	,	,	PUNCT
ajst-32394	108	15	physicochemical	physicochemical	ADJ
ajst-32394	108	16	,	,	PUNCT
ajst-32394	108	17	and	and	CCONJ
ajst-32394	108	18	proteomic	proteomic	NOUN
ajst-32394	108	19	—	—	PUNCT
ajst-32394	108	20	to	to	PART
ajst-32394	108	21	mitigate	mitigate	VERB
ajst-32394	108	22	cold	cold	ADJ
ajst-32394	108	23	-	-	PUNCT
ajst-32394	108	24	start	start	NOUN
ajst-32394	108	25	quandaries	quandary	NOUN
ajst-32394	108	26	,	,	PUNCT
ajst-32394	108	27	where	where	SCONJ
ajst-32394	108	28	novel	novel	ADJ
ajst-32394	108	29	entities	entity	NOUN
ajst-32394	108	30	evade	evade	VERB
ajst-32394	108	31	empirical	empirical	ADJ
ajst-32394	108	32	precedents	precedent	NOUN
ajst-32394	108	33	[	[	X
ajst-32394	108	34	37	37	NUM
ajst-32394	108	35	,	,	PUNCT
ajst-32394	108	36	38	38	NUM
ajst-32394	108	37	]	]	PUNCT
ajst-32394	108	38	.	.	PUNCT
ajst-32394	109	1	in	in	ADP
ajst-32394	109	2	natural	natural	ADJ
ajst-32394	109	3	product	product	NOUN
ajst-32394	109	4	mining	mining	NOUN
ajst-32394	109	5	for	for	ADP
ajst-32394	109	6	kinase	kinase	PROPN
ajst-32394	109	7	inhibitors	inhibitor	NOUN
ajst-32394	109	8	,	,	PUNCT
ajst-32394	109	9	ml	ml	VERB
ajst-32394	109	10	-	-	PUNCT
ajst-32394	109	11	augmented	augment	VERB
ajst-32394	109	12	virtual	virtual	ADJ
ajst-32394	109	13	screening	screening	NOUN
ajst-32394	109	14	exemplifies	exemplify	VERB
ajst-32394	109	15	precision	precision	NOUN
ajst-32394	109	16	triage	triage	NOUN
ajst-32394	109	17	.	.	PUNCT
ajst-32394	110	1	a	a	DET
ajst-32394	110	2	pipeline	pipeline	NOUN
ajst-32394	110	3	processed	process	VERB
ajst-32394	110	4	a	a	DET
ajst-32394	110	5	training	training	NOUN
ajst-32394	110	6	corpus	corpus	NOUN
ajst-32394	110	7	via	via	ADP
ajst-32394	110	8	similarity	similarity	NOUN
ajst-32394	110	9	pruning	prune	VERB
ajst-32394	110	10	to	to	PART
ajst-32394	110	11	align	align	VERB
ajst-32394	110	12	with	with	ADP
ajst-32394	110	13	a	a	DET
ajst-32394	110	14	natural	natural	ADJ
ajst-32394	110	15	products	product	NOUN
ajst-32394	110	16	repository	repository	NOUN
ajst-32394	110	17	,	,	PUNCT
ajst-32394	110	18	engendering	engender	VERB
ajst-32394	110	19	six	six	NUM
ajst-32394	110	20	classifiers	classifier	NOUN
ajst-32394	110	21	from	from	ADP
ajst-32394	110	22	dual	dual	ADJ
ajst-32394	110	23	feature	feature	NOUN
ajst-32394	110	24	sets	set	NOUN
ajst-32394	110	25	—	—	PUNCT
ajst-32394	110	26	ecfp	ecfp	NOUN
ajst-32394	110	27	fingerprints	fingerprint	NOUN
ajst-32394	110	28	and	and	CCONJ
ajst-32394	110	29	pharmacophore	pharmacophore	NOUN
ajst-32394	110	30	descriptors	descriptor	NOUN
ajst-32394	110	31	—	—	PUNCT
ajst-32394	110	32	interrogated	interrogate	VERB
ajst-32394	110	33	by	by	ADP
ajst-32394	110	34	logistic	logistic	ADJ
ajst-32394	110	35	regression	regression	NOUN
ajst-32394	110	36	,	,	PUNCT
ajst-32394	110	37	random	random	ADJ
ajst-32394	110	38	forests	forest	NOUN
ajst-32394	110	39	,	,	PUNCT
ajst-32394	110	40	and	and	CCONJ
ajst-32394	110	41	support	support	VERB
ajst-32394	110	42	vector	vector	NOUN
ajst-32394	110	43	machines	machine	NOUN
ajst-32394	110	44	.	.	PUNCT
ajst-32394	111	1	post	post	ADJ
ajst-32394	111	2	-	-	ADJ
ajst-32394	111	3	rigorous	rigorous	ADJ
ajst-32394	111	4	evaluation	evaluation	NOUN
ajst-32394	111	5	,	,	PUNCT
ajst-32394	111	6	the	the	DET
ajst-32394	111	7	triad	triad	NOUN
ajst-32394	111	8	of	of	ADP
ajst-32394	111	9	top	top	ADJ
ajst-32394	111	10	performers	performer	NOUN
ajst-32394	111	11	culled	cull	VERB
ajst-32394	111	12	15	15	NUM
ajst-32394	111	13	candidates	candidate	NOUN
ajst-32394	111	14	for	for	ADP
ajst-32394	111	15	enzymatic	enzymatic	ADJ
ajst-32394	111	16	assay	assay	NOUN
ajst-32394	111	17	;	;	PUNCT
ajst-32394	111	18	picrasidine	picrasidine	NOUN
ajst-32394	111	19	s	s	PROPN
ajst-32394	111	20	,	,	PUNCT
ajst-32394	111	21	a	a	DET
ajst-32394	111	22	quassinoid	quassinoid	NOUN
ajst-32394	111	23	alkaloid	alkaloid	NOUN
ajst-32394	111	24	,	,	PUNCT
ajst-32394	111	25	surfaced	surface	VERB
ajst-32394	111	26	as	as	ADP
ajst-32394	111	27	a	a	DET
ajst-32394	111	28	p38α	p38α	NOUN
ajst-32394	111	29	antagonist	antagonist	NOUN
ajst-32394	111	30	with	with	ADP
ajst-32394	111	31	34.14	34.14	NUM
ajst-32394	111	32	μm	μm	NOUN
ajst-32394	111	33	ic50	ic50	PROPN
ajst-32394	111	34	,	,	PUNCT
ajst-32394	111	35	corroborated	corroborate	VERB
ajst-32394	111	36	by	by	ADP
ajst-32394	111	37	docking	dock	VERB
ajst-32394	111	38	simulations	simulation	NOUN
ajst-32394	111	39	evincing	evince	VERB
ajst-32394	111	40	a	a	DET
ajst-32394	111	41	met109	met109	ADJ
ajst-32394	111	42	hydrogen	hydrogen	NOUN
ajst-32394	111	43	bond	bond	NOUN
ajst-32394	111	44	stabilizing	stabilize	VERB
ajst-32394	111	45	the	the	DET
ajst-32394	111	46	atp	atp	NOUN
ajst-32394	111	47	pocket	pocket	NOUN
ajst-32394	111	48	[	[	X
ajst-32394	111	49	39	39	NUM
ajst-32394	111	50	]	]	PUNCT
ajst-32394	111	51	.	.	PUNCT
ajst-32394	112	1	this	this	DET
ajst-32394	112	2	workflow	workflow	NOUN
ajst-32394	112	3	,	,	PUNCT
ajst-32394	112	4	extensible	extensible	ADJ
ajst-32394	112	5	to	to	ADP
ajst-32394	112	6	toxicant	toxicant	ADJ
ajst-32394	112	7	profiling	profiling	NOUN
ajst-32394	112	8	,	,	PUNCT
ajst-32394	112	9	discriminates	discriminate	VERB
ajst-32394	112	10	promiscuous	promiscuous	ADJ
ajst-32394	112	11	binders	binder	NOUN
ajst-32394	112	12	—	—	PUNCT
ajst-32394	112	13	e.g.	e.g.	ADV
ajst-32394	112	14	,	,	PUNCT
ajst-32394	112	15	polyphenol	polyphenol	VERB
ajst-32394	112	16	off	off	ADP
ajst-32394	112	17	-	-	PUNCT
ajst-32394	112	18	targets	target	NOUN
ajst-32394	112	19	—	—	PUNCT
ajst-32394	112	20	from	from	ADP
ajst-32394	112	21	selective	selective	ADJ
ajst-32394	112	22	moieties	moiety	NOUN
ajst-32394	112	23	,	,	PUNCT
ajst-32394	112	24	curbing	curb	VERB
ajst-32394	112	25	idiosyncratic	idiosyncratic	ADJ
ajst-32394	112	26	toxicities	toxicity	NOUN
ajst-32394	112	27	.	.	PUNCT
ajst-32394	113	1	contemporary	contemporary	ADJ
ajst-32394	113	2	2025	2025	NUM
ajst-32394	113	3	iterations	iteration	NOUN
ajst-32394	113	4	,	,	PUNCT
ajst-32394	113	5	per	per	ADP
ajst-32394	113	6	yang	yang	PROPN
ajst-32394	113	7	and	and	CCONJ
ajst-32394	113	8	cheng	cheng	PROPN
ajst-32394	113	9	's	's	PART
ajst-32394	113	10	synthesis	synthesis	NOUN
ajst-32394	113	11	,	,	PUNCT
ajst-32394	113	12	infuse	infuse	VERB
ajst-32394	113	13	graph	graph	NOUN
ajst-32394	113	14	neural	neural	ADJ
ajst-32394	113	15	networks	network	NOUN
ajst-32394	113	16	(	(	PUNCT
ajst-32394	113	17	gnns	gnns	NOUN
ajst-32394	113	18	)	)	PUNCT
ajst-32394	113	19	to	to	PART
ajst-32394	113	20	encode	encode	VERB
ajst-32394	113	21	ligand	ligand	NOUN
ajst-32394	113	22	topologies	topology	NOUN
ajst-32394	113	23	,	,	PUNCT
ajst-32394	113	24	boosting	boost	VERB
ajst-32394	113	25	hit	hit	NOUN
ajst-32394	113	26	rates	rate	NOUN
ajst-32394	113	27	by	by	ADP
ajst-32394	113	28	25	25	NUM
ajst-32394	113	29	%	%	NOUN
ajst-32394	113	30	in	in	ADP
ajst-32394	113	31	kinase	kinase	NOUN
ajst-32394	113	32	panels	panel	NOUN
ajst-32394	113	33	while	while	SCONJ
ajst-32394	113	34	flagging	flag	VERB
ajst-32394	113	35	reactive	reactive	ADJ
ajst-32394	113	36	warheads	warhead	NOUN
ajst-32394	113	37	akin	akin	ADJ
ajst-32394	113	38	to	to	ADP
ajst-32394	113	39	michael	michael	PROPN
ajst-32394	113	40	acceptors	acceptor	NOUN
ajst-32394	113	41	in	in	ADP
ajst-32394	113	42	environmental	environmental	ADJ
ajst-32394	113	43	toxicants	toxicant	NOUN
ajst-32394	113	44	[	[	X
ajst-32394	113	45	40	40	NUM
ajst-32394	113	46	]	]	PUNCT
ajst-32394	113	47	.	.	PUNCT
ajst-32394	114	1	drug	drug	NOUN
ajst-32394	114	2	-	-	PUNCT
ajst-32394	114	3	target	target	NOUN
ajst-32394	114	4	interaction	interaction	NOUN
ajst-32394	114	5	(	(	PUNCT
ajst-32394	114	6	dti	dti	PROPN
ajst-32394	114	7	)	)	PUNCT
ajst-32394	114	8	forecasting	forecasting	NOUN
ajst-32394	114	9	grapples	grapple	VERB
ajst-32394	114	10	with	with	ADP
ajst-32394	114	11	the	the	DET
ajst-32394	114	12	cold	cold	ADJ
ajst-32394	114	13	-	-	PUNCT
ajst-32394	114	14	start	start	NOUN
ajst-32394	114	15	conundrum	conundrum	NOUN
ajst-32394	114	16	,	,	PUNCT
ajst-32394	114	17	wherein	wherein	ADJ
ajst-32394	114	18	de	de	X
ajst-32394	114	19	novo	novo	NOUN
ajst-32394	114	20	scaffolds	scaffold	NOUN
ajst-32394	114	21	or	or	CCONJ
ajst-32394	114	22	orphan	orphan	NOUN
ajst-32394	114	23	proteins	protein	NOUN
ajst-32394	114	24	confound	confound	VERB
ajst-32394	114	25	extrapolations	extrapolation	NOUN
ajst-32394	114	26	,	,	PUNCT
ajst-32394	114	27	yielding	yield	VERB
ajst-32394	114	28	precipitous	precipitous	ADJ
ajst-32394	114	29	accuracy	accuracy	NOUN
ajst-32394	114	30	erosions	erosion	NOUN
ajst-32394	114	31	[	[	X
ajst-32394	114	32	41	41	NUM
ajst-32394	114	33	]	]	PUNCT
ajst-32394	114	34	.	.	PUNCT
ajst-32394	115	1	to	to	PART
ajst-32394	115	2	redress	redress	VERB
ajst-32394	115	3	this	this	PRON
ajst-32394	115	4	,	,	PUNCT
ajst-32394	115	5	transfer	transfer	NOUN
ajst-32394	115	6	learning	learning	NOUN
ajst-32394	115	7	paradigms	paradigm	NOUN
ajst-32394	115	8	bootstrap	bootstrap	NOUN
ajst-32394	115	9	from	from	ADP
ajst-32394	115	10	ancillary	ancillary	ADJ
ajst-32394	115	11	tasks	task	NOUN
ajst-32394	115	12	—	—	PUNCT
ajst-32394	115	13	chemical	chemical	NOUN
ajst-32394	115	14	-	-	PUNCT
ajst-32394	115	15	chemical	chemical	NOUN
ajst-32394	115	16	interactions	interaction	NOUN
ajst-32394	115	17	(	(	PUNCT
ajst-32394	115	18	cci	cci	NOUN
ajst-32394	115	19	)	)	PUNCT
ajst-32394	115	20	and	and	CCONJ
ajst-32394	115	21	protein	protein	NOUN
ajst-32394	115	22	-	-	PUNCT
ajst-32394	115	23	protein	protein	NOUN
ajst-32394	115	24	interfaces	interface	NOUN
ajst-32394	115	25	(	(	PUNCT
ajst-32394	115	26	ppi)—to	ppi)—to	PRON
ajst-32394	115	27	seed	seed	NOUN
ajst-32394	115	28	dti	dti	PROPN
ajst-32394	115	29	manifolds	manifolds	PROPN
ajst-32394	115	30	.	.	PUNCT
ajst-32394	116	1	representations	representation	NOUN
ajst-32394	116	2	distilled	distil	VERB
ajst-32394	116	3	from	from	ADP
ajst-32394	116	4	cci	cci	NOUN
ajst-32394	116	5	graphs	graph	NOUN
ajst-32394	116	6	(	(	PUNCT
ajst-32394	116	7	e.g.	e.g.	ADV
ajst-32394	116	8	,	,	PUNCT
ajst-32394	116	9	morgan	morgan	PROPN
ajst-32394	116	10	fingerprints	fingerprint	NOUN
ajst-32394	116	11	)	)	PUNCT
ajst-32394	116	12	and	and	CCONJ
ajst-32394	116	13	ppi	ppi	NOUN
ajst-32394	116	14	embeddings	embedding	NOUN
ajst-32394	116	15	(	(	PUNCT
ajst-32394	116	16	e.g.	e.g.	ADV
ajst-32394	116	17	,	,	PUNCT
ajst-32394	116	18	alphafold	alphafold	ADJ
ajst-32394	116	19	-	-	PUNCT
ajst-32394	116	20	derived	derive	VERB
ajst-32394	116	21	contacts	contact	NOUN
ajst-32394	116	22	)	)	PUNCT
ajst-32394	116	23	transfer	transfer	VERB
ajst-32394	116	24	fluidly	fluidly	ADV
ajst-32394	116	25	,	,	PUNCT
ajst-32394	116	26	augmenting	augment	VERB
ajst-32394	116	27	sparse	sparse	ADJ
ajst-32394	116	28	dti	dti	PROPN
ajst-32394	116	29	datasets	dataset	NOUN
ajst-32394	116	30	via	via	ADP
ajst-32394	116	31	pre	pre	ADJ
ajst-32394	116	32	-	-	ADJ
ajst-32394	116	33	trained	train	VERB
ajst-32394	116	34	encoders	encoder	NOUN
ajst-32394	116	35	like	like	VERB
ajst-32394	116	36	esm-2	esm-2	NOUN
ajst-32394	116	37	for	for	ADP
ajst-32394	116	38	proteins	protein	NOUN
ajst-32394	116	39	and	and	CCONJ
ajst-32394	116	40	chemberta	chemberta	NOUN
ajst-32394	116	41	for	for	ADP
ajst-32394	116	42	ligands	ligand	NOUN
ajst-32394	116	43	.	.	PUNCT
ajst-32394	117	1	on	on	ADP
ajst-32394	117	2	benchmarks	benchmark	NOUN
ajst-32394	117	3	like	like	ADP
ajst-32394	117	4	bindingdb	bindingdb	PROPN
ajst-32394	117	5	,	,	PUNCT
ajst-32394	117	6	this	this	DET
ajst-32394	117	7	yields	yield	NOUN
ajst-32394	117	8	auc	auc	VERB
ajst-32394	117	9	uplifts	uplift	NOUN
ajst-32394	117	10	of	of	ADP
ajst-32394	117	11	0.05	0.05	NUM
ajst-32394	117	12	-	-	SYM
ajst-32394	117	13	0.10	0.10	NUM
ajst-32394	117	14	over	over	ADP
ajst-32394	117	15	vanilla	vanilla	NOUN
ajst-32394	117	16	deep	deep	ADJ
ajst-32394	117	17	neural	neural	ADJ
ajst-32394	117	18	nets	net	NOUN
ajst-32394	117	19	,	,	PUNCT
ajst-32394	117	20	particularly	particularly	ADV
ajst-32394	117	21	for	for	ADP
ajst-32394	117	22	low	low	ADJ
ajst-32394	117	23	-	-	PUNCT
ajst-32394	117	24	data	data	NOUN
ajst-32394	117	25	regimes	regime	NOUN
ajst-32394	117	26	emblematic	emblematic	ADJ
ajst-32394	117	27	of	of	ADP
ajst-32394	117	28	rare	rare	ADJ
ajst-32394	117	29	toxicants	toxicant	NOUN
ajst-32394	117	30	like	like	ADP
ajst-32394	117	31	perfluorocarbons	perfluorocarbon	NOUN
ajst-32394	117	32	.	.	PUNCT
ajst-32394	118	1	2025	2025	NUM
ajst-32394	118	2	advancements	advancement	NOUN
ajst-32394	118	3	,	,	PUNCT
ajst-32394	118	4	as	as	ADP
ajst-32394	118	5	in	in	ADP
ajst-32394	118	6	talukder	talukder	NOUN
ajst-32394	118	7	et	et	PROPN
ajst-32394	118	8	al	al	PROPN
ajst-32394	118	9	.	.	PROPN
ajst-32394	118	10	's	's	PART
ajst-32394	118	11	hybrid	hybrid	ADJ
ajst-32394	118	12	ml	ml	PROPN
ajst-32394	118	13	-	-	PUNCT
ajst-32394	118	14	dl	dl	NOUN
ajst-32394	118	15	framework	framework	NOUN
ajst-32394	118	16	,	,	PUNCT
ajst-32394	118	17	incorporate	incorporate	VERB
ajst-32394	118	18	resampling	resample	VERB
ajst-32394	118	19	for	for	ADP
ajst-32394	118	20	class	class	NOUN
ajst-32394	118	21	equilibrium	equilibrium	NOUN
ajst-32394	118	22	and	and	CCONJ
ajst-32394	118	23	shap	shap	NOUN
ajst-32394	118	24	-	-	PUNCT
ajst-32394	118	25	driven	drive	VERB
ajst-32394	118	26	feature	feature	NOUN
ajst-32394	118	27	pruning	prune	VERB
ajst-32394	118	28	,	,	PUNCT
ajst-32394	118	29	attaining	attain	VERB
ajst-32394	118	30	0.92	0.92	NUM
ajst-32394	118	31	f1scores	f1score	NOUN
ajst-32394	118	32	on	on	ADP
ajst-32394	118	33	imbalanced	imbalanced	ADJ
ajst-32394	118	34	toxicant	toxicant	ADJ
ajst-32394	118	35	-	-	PUNCT
ajst-32394	118	36	target	target	NOUN
ajst-32394	118	37	pairs	pair	NOUN
ajst-32394	118	38	while	while	SCONJ
ajst-32394	118	39	explicating	explicate	VERB
ajst-32394	118	40	lipophilicity	lipophilicity	NOUN
ajst-32394	118	41	's	's	PART
ajst-32394	118	42	primacy	primacy	NOUN
ajst-32394	118	43	in	in	ADP
ajst-32394	118	44	membrane	membrane	ADJ
ajst-32394	118	45	disruptors	disruptor	NOUN
ajst-32394	118	46	[	[	X
ajst-32394	118	47	42	42	NUM
ajst-32394	118	48	]	]	PUNCT
ajst-32394	118	49	.	.	PUNCT
ajst-32394	119	1	such	such	ADJ
ajst-32394	119	2	transferability	transferability	NOUN
ajst-32394	119	3	fortifies	fortify	VERB
ajst-32394	119	4	polypharmacy	polypharmacy	NOUN
ajst-32394	119	5	simulations	simulation	NOUN
ajst-32394	119	6	,	,	PUNCT
ajst-32394	119	7	prognosticating	prognosticate	VERB
ajst-32394	119	8	synergistic	synergistic	ADJ
ajst-32394	119	9	toxicities	toxicity	NOUN
ajst-32394	119	10	in	in	ADP
ajst-32394	119	11	co	co	NOUN
ajst-32394	119	12	-	-	NOUN
ajst-32394	119	13	exposures	exposure	NOUN
ajst-32394	119	14	.	.	PUNCT
ajst-32394	120	1	high	high	ADJ
ajst-32394	120	2	-	-	PUNCT
ajst-32394	120	3	throughput	throughput	NOUN
ajst-32394	120	4	ml	ml	NOUN
ajst-32394	120	5	further	further	ADJ
ajst-32394	120	6	probes	probe	NOUN
ajst-32394	120	7	viral	viral	ADJ
ajst-32394	120	8	-	-	PUNCT
ajst-32394	120	9	host	host	NOUN
ajst-32394	120	10	rna	rna	NOUN
ajst-32394	120	11	interactomes	interactome	NOUN
ajst-32394	120	12	,	,	PUNCT
ajst-32394	120	13	dissecting	dissect	VERB
ajst-32394	120	14	evolutionary	evolutionary	ADJ
ajst-32394	120	15	sculpting	sculpting	NOUN
ajst-32394	120	16	of	of	ADP
ajst-32394	120	17	pathogenetic	pathogenetic	ADJ
ajst-32394	120	18	circuits	circuit	NOUN
ajst-32394	120	19	.	.	PUNCT
ajst-32394	121	1	feature	feature	NOUN
ajst-32394	121	2	extraction	extraction	NOUN
ajst-32394	121	3	from	from	ADP
ajst-32394	121	4	sequence	sequence	NOUN
ajst-32394	121	5	alignments	alignment	NOUN
ajst-32394	121	6	and	and	CCONJ
ajst-32394	121	7	secondary	secondary	ADJ
ajst-32394	121	8	structures	structure	NOUN
ajst-32394	121	9	,	,	PUNCT
ajst-32394	121	10	fed	feed	VERB
ajst-32394	121	11	into	into	ADP
ajst-32394	121	12	gradient	gradient	NOUN
ajst-32394	121	13	boosting	boost	VERB
ajst-32394	121	14	or	or	CCONJ
ajst-32394	121	15	convolutional	convolutional	ADJ
ajst-32394	121	16	nets	net	NOUN
ajst-32394	121	17	,	,	PUNCT
ajst-32394	121	18	unveils	unveils	AUX
ajst-32394	121	19	conserved	conserve	VERB
ajst-32394	121	20	viral	viral	ADJ
ajst-32394	121	21	effectors	effector	NOUN
ajst-32394	121	22	—	—	PUNCT
ajst-32394	121	23	e.g.	e.g.	ADV
ajst-32394	121	24	,	,	PUNCT
ajst-32394	121	25	nsp3	nsp3	PROPN
ajst-32394	121	26	's	's	PART
ajst-32394	121	27	mirna	mirna	PROPN
ajst-32394	121	28	sequestration	sequestration	NOUN
ajst-32394	121	29	in	in	ADP
ajst-32394	121	30	coronaviruses	coronaviruse	NOUN
ajst-32394	121	31	—	—	PUNCT
ajst-32394	121	32	pruning	prune	VERB
ajst-32394	121	33	extraneous	extraneous	ADJ
ajst-32394	121	34	rna	rna	NOUN
ajst-32394	121	35	-	-	PUNCT
ajst-32394	121	36	binding	bind	VERB
ajst-32394	121	37	domains	domain	NOUN
ajst-32394	121	38	while	while	SCONJ
ajst-32394	121	39	preserving	preserve	VERB
ajst-32394	121	40	replicative	replicative	ADJ
ajst-32394	121	41	cores	core	NOUN
ajst-32394	121	42	[	[	X
ajst-32394	121	43	43	43	NUM
ajst-32394	121	44	]	]	PUNCT
ajst-32394	121	45	.	.	PUNCT
ajst-32394	122	1	go	go	VERB
ajst-32394	122	2	enrichment	enrichment	NOUN
ajst-32394	122	3	of	of	ADP
ajst-32394	122	4	nsp3	nsp3	PROPN
ajst-32394	122	5	-	-	PUNCT
ajst-32394	122	6	affiliated	affiliate	VERB
ajst-32394	122	7	mirnas	mirna	NOUN
ajst-32394	122	8	implicates	implicate	VERB
ajst-32394	122	9	symptom	symptom	NOUN
ajst-32394	122	10	correlates	correlate	VERB
ajst-32394	122	11	like	like	ADP
ajst-32394	122	12	coagulopathy	coagulopathy	ADJ
ajst-32394	122	13	in	in	ADP
ajst-32394	122	14	covid-19	covid-19	PROPN
ajst-32394	122	15	,	,	PUNCT
ajst-32394	122	16	with	with	ADP
ajst-32394	122	17	docking	docking	NOUN
ajst-32394	122	18	-	-	PUNCT
ajst-32394	122	19	md	md	PROPN
ajst-32394	122	20	hybrids	hybrid	NOUN
ajst-32394	122	21	nominating	nominate	VERB
ajst-32394	122	22	toxi	toxi	NOUN
ajst-32394	122	23	,	,	PUNCT
ajst-32394	122	24	an	an	DET
ajst-32394	122	25	rna	rna	NOUN
ajst-32394	122	26	antitoxin	antitoxin	NOUN
ajst-32394	122	27	,	,	PUNCT
ajst-32394	122	28	as	as	ADP
ajst-32394	122	29	an	an	DET
ajst-32394	122	30	nsp5	nsp5	PROPN
ajst-32394	122	31	aptamer	aptamer	NOUN
ajst-32394	122	32	sequestering	sequestering	NOUN
ajst-32394	122	33	endoribonuclease	endoribonuclease	NOUN
ajst-32394	122	34	activity	activity	NOUN
ajst-32394	122	35	.	.	PUNCT
ajst-32394	123	1	recent	recent	ADJ
ajst-32394	123	2	2025	2025	NUM
ajst-32394	123	3	extensions	extension	NOUN
ajst-32394	123	4	,	,	PUNCT
ajst-32394	123	5	per	per	ADP
ajst-32394	123	6	liu	liu	PROPN
ajst-32394	123	7	et	et	PROPN
ajst-32394	123	8	al	al	PROPN
ajst-32394	123	9	.	.	PROPN
ajst-32394	123	10	's	's	PART
ajst-32394	123	11	network	network	NOUN
ajst-32394	123	12	-	-	PUNCT
ajst-32394	123	13	guided	guide	VERB
ajst-32394	123	14	dl	dl	PROPN
ajst-32394	123	15	,	,	PUNCT
ajst-32394	123	16	fuse	fuse	NOUN
ajst-32394	123	17	gnns	gnns	NOUN
ajst-32394	123	18	with	with	ADP
ajst-32394	123	19	esmfold	esmfold	ADJ
ajst-32394	123	20	embeddings	embedding	NOUN
ajst-32394	123	21	to	to	PART
ajst-32394	123	22	predict	predict	VERB
ajst-32394	123	23	dynamic	dynamic	ADJ
ajst-32394	123	24	vrnarbp	vrnarbp	ADJ
ajst-32394	123	25	hubs	hub	NOUN
ajst-32394	123	26	,	,	PUNCT
ajst-32394	123	27	unmasking	unmask	VERB
ajst-32394	123	28	zika	zika	NOUN
ajst-32394	123	29	's	's	PART
ajst-32394	123	30	ns5	ns5	NOUN
ajst-32394	123	31	methyltransferase	methyltransferase	NOUN
ajst-32394	123	32	modulation	modulation	NOUN
ajst-32394	123	33	of	of	ADP
ajst-32394	123	34	host	host	NOUN
ajst-32394	123	35	splicing	splicing	NOUN
ajst-32394	123	36	at	at	ADP
ajst-32394	123	37	0.87	0.87	NUM
ajst-32394	123	38	auc	auc	NOUN
ajst-32394	123	39	,	,	PUNCT
ajst-32394	123	40	thereby	thereby	ADV
ajst-32394	123	41	nominating	nominate	VERB
ajst-32394	123	42	antivirals	antiviral	NOUN
ajst-32394	123	43	targeting	target	VERB
ajst-32394	123	44	conserved	conserve	VERB
ajst-32394	123	45	hairpins	hairpin	NOUN
ajst-32394	123	46	[	[	X
ajst-32394	123	47	44	44	NUM
ajst-32394	123	48	]	]	PUNCT
ajst-32394	123	49	.	.	PUNCT
ajst-32394	124	1	this	this	DET
ajst-32394	124	2	lens	lens	NOUN
ajst-32394	124	3	extends	extend	VERB
ajst-32394	124	4	to	to	ADP
ajst-32394	124	5	toxicant	toxicant	ADJ
ajst-32394	124	6	-	-	PUNCT
ajst-32394	124	7	mimetic	mimetic	ADJ
ajst-32394	124	8	virulences	virulence	NOUN
ajst-32394	124	9	,	,	PUNCT
ajst-32394	124	10	forecasting	forecast	VERB
ajst-32394	124	11	rna	rna	NOUN
ajst-32394	124	12	-	-	PUNCT
ajst-32394	124	13	adduct	adduct	NOUN
ajst-32394	124	14	formations	formation	NOUN
ajst-32394	124	15	in	in	ADP
ajst-32394	124	16	alkylating	alkylate	VERB
ajst-32394	124	17	agents	agent	NOUN
ajst-32394	124	18	.	.	PUNCT
ajst-32394	125	1	in	in	ADP
ajst-32394	125	2	confluence	confluence	NOUN
ajst-32394	125	3	,	,	PUNCT
ajst-32394	125	4	these	these	DET
ajst-32394	125	5	ml	ml	NOUN
ajst-32394	125	6	stratagems	stratagem	NOUN
ajst-32394	125	7	—	—	PUNCT
ajst-32394	125	8	from	from	ADP
ajst-32394	125	9	classifier	classifier	NOUN
ajst-32394	125	10	cascades	cascade	NOUN
ajst-32394	125	11	to	to	PART
ajst-32394	125	12	transfer	transfer	VERB
ajst-32394	125	13	-	-	PUNCT
ajst-32394	125	14	learned	learn	VERB
ajst-32394	125	15	embeddings	embedding	NOUN
ajst-32394	125	16	—	—	PUNCT
ajst-32394	125	17	demystify	demystify	VERB
ajst-32394	125	18	toxicant	toxicant	ADJ
ajst-32394	125	19	-	-	PUNCT
ajst-32394	125	20	target	target	NOUN
ajst-32394	125	21	symbioses	symbiose	NOUN
ajst-32394	125	22	,	,	PUNCT
ajst-32394	125	23	as	as	ADP
ajst-32394	125	24	2025	2025	NUM
ajst-32394	125	25	compendia	compendia	NOUN
ajst-32394	125	26	affirm	affirm	NOUN
ajst-32394	125	27	[	[	X
ajst-32394	125	28	45	45	NUM
ajst-32394	125	29	]	]	PUNCT
ajst-32394	125	30	.	.	PUNCT
ajst-32394	126	1	by	by	ADP
ajst-32394	126	2	imputing	impute	VERB
ajst-32394	126	3	biophysical	biophysical	ADJ
ajst-32394	126	4	207	207	NUM
ajst-32394	126	5	fidelities	fidelity	NOUN
ajst-32394	126	6	sans	san	NOUN
ajst-32394	126	7	crystallographic	crystallographic	ADJ
ajst-32394	126	8	imperatives	imperative	NOUN
ajst-32394	126	9	,	,	PUNCT
ajst-32394	126	10	they	they	PRON
ajst-32394	126	11	propel	propel	VERB
ajst-32394	126	12	antidote	antidote	NOUN
ajst-32394	126	13	engineering	engineering	NOUN
ajst-32394	126	14	and	and	CCONJ
ajst-32394	126	15	polytoxicant	polytoxicant	ADJ
ajst-32394	126	16	surveillance	surveillance	NOUN
ajst-32394	126	17	,	,	PUNCT
ajst-32394	126	18	transmuting	transmute	VERB
ajst-32394	126	19	empirical	empirical	ADJ
ajst-32394	126	20	drudgery	drudgery	NOUN
ajst-32394	126	21	into	into	ADP
ajst-32394	126	22	prescient	prescient	NOUN
ajst-32394	126	23	prophylaxis	prophylaxis	NOUN
ajst-32394	126	24	amid	amid	ADP
ajst-32394	126	25	emergent	emergent	ADJ
ajst-32394	126	26	threats	threat	NOUN
ajst-32394	126	27	.	.	PUNCT
ajst-32394	127	1	7	7	X
ajst-32394	127	2	.	.	X
ajst-32394	127	3	mechanistic	mechanistic	ADJ
ajst-32394	127	4	insights	insight	NOUN
ajst-32394	127	5	into	into	ADP
ajst-32394	127	6	toxicology	toxicology	NOUN
ajst-32394	127	7	through	through	ADP
ajst-32394	127	8	machine	machine	NOUN
ajst-32394	127	9	learning	learning	NOUN
ajst-32394	127	10	ml	ml	AUX
ajst-32394	127	11	is	be	AUX
ajst-32394	127	12	contributing	contribute	VERB
ajst-32394	127	13	profound	profound	ADJ
ajst-32394	127	14	mechanistic	mechanistic	ADJ
ajst-32394	127	15	insights	insight	NOUN
ajst-32394	127	16	into	into	ADP
ajst-32394	127	17	toxicology	toxicology	NOUN
ajst-32394	127	18	,	,	PUNCT
ajst-32394	127	19	clarifying	clarify	VERB
ajst-32394	127	20	the	the	DET
ajst-32394	127	21	molecular	molecular	ADJ
ajst-32394	127	22	choreography	choreography	NOUN
ajst-32394	127	23	by	by	ADP
ajst-32394	127	24	which	which	PRON
ajst-32394	127	25	xenobiotics	xenobiotic	NOUN
ajst-32394	127	26	trigger	trigger	VERB
ajst-32394	127	27	adverse	adverse	ADJ
ajst-32394	127	28	effects	effect	NOUN
ajst-32394	127	29	,	,	PUNCT
ajst-32394	127	30	from	from	ADP
ajst-32394	127	31	substructural	substructural	ADJ
ajst-32394	127	32	problems	problem	NOUN
ajst-32394	127	33	to	to	ADP
ajst-32394	127	34	pathway	pathway	NOUN
ajst-32394	127	35	disruptions	disruption	NOUN
ajst-32394	127	36	.	.	PUNCT
ajst-32394	128	1	as	as	SCONJ
ajst-32394	128	2	black	black	NOUN
ajst-32394	128	3	-	-	PUNCT
ajst-32394	128	4	box	box	NOUN
ajst-32394	128	5	critiques	critique	NOUN
ajst-32394	128	6	wane	wane	NOUN
ajst-32394	128	7	amid	amid	ADP
ajst-32394	128	8	explainable	explainable	ADJ
ajst-32394	128	9	ai	ai	NOUN
ajst-32394	128	10	(	(	PUNCT
ajst-32394	128	11	xai	xai	PROPN
ajst-32394	128	12	)	)	PUNCT
ajst-32394	128	13	surges	surge	VERB
ajst-32394	128	14	,	,	PUNCT
ajst-32394	128	15	ml	ml	ADP
ajst-32394	128	16	bridges	bridge	NOUN
ajst-32394	128	17	predictive	predictive	ADJ
ajst-32394	128	18	prowess	prowess	NOUN
ajst-32394	128	19	with	with	ADP
ajst-32394	128	20	causal	causal	ADJ
ajst-32394	128	21	elucidation	elucidation	NOUN
ajst-32394	128	22	,	,	PUNCT
ajst-32394	128	23	as	as	SCONJ
ajst-32394	128	24	affirmed	affirm	VERB
ajst-32394	128	25	in	in	ADP
ajst-32394	128	26	bai	bai	PROPN
ajst-32394	128	27	's	's	PART
ajst-32394	128	28	2025	2025	NUM
ajst-32394	128	29	compendium	compendium	NOUN
ajst-32394	128	30	on	on	ADP
ajst-32394	128	31	drug	drug	NOUN
ajst-32394	128	32	-	-	PUNCT
ajst-32394	128	33	induced	induce	VERB
ajst-32394	128	34	toxicities	toxicity	NOUN
ajst-32394	128	35	,	,	PUNCT
ajst-32394	128	36	where	where	SCONJ
ajst-32394	128	37	interpretable	interpretable	ADJ
ajst-32394	128	38	models	model	NOUN
ajst-32394	128	39	dissect	dissect	VERB
ajst-32394	128	40	10	10	NUM
ajst-32394	128	41	organ	organ	NOUN
ajst-32394	128	42	-	-	PUNCT
ajst-32394	128	43	specific	specific	ADJ
ajst-32394	128	44	endpoints	endpoint	NOUN
ajst-32394	128	45	,	,	PUNCT
ajst-32394	128	46	revealing	reveal	VERB
ajst-32394	128	47	structural	structural	ADJ
ajst-32394	128	48	motifs	motif	NOUN
ajst-32394	128	49	and	and	CCONJ
ajst-32394	128	50	omics	omic	NOUN
ajst-32394	128	51	correlates	correlate	VERB
ajst-32394	128	52	that	that	SCONJ
ajst-32394	128	53	underpin	underpin	VERB
ajst-32394	128	54	idiosyncratic	idiosyncratic	ADJ
ajst-32394	128	55	reactions	reaction	NOUN
ajst-32394	128	56	.	.	PUNCT
ajst-32394	129	1	the	the	DET
ajst-32394	129	2	methodology	methodology	NOUN
ajst-32394	129	3	not	not	PART
ajst-32394	129	4	only	only	ADV
ajst-32394	129	5	facilitates	facilitate	VERB
ajst-32394	129	6	the	the	DET
ajst-32394	129	7	prediction	prediction	NOUN
ajst-32394	129	8	of	of	ADP
ajst-32394	129	9	toxicity	toxicity	NOUN
ajst-32394	129	10	but	but	CCONJ
ajst-32394	129	11	also	also	ADV
ajst-32394	129	12	aids	aid	VERB
ajst-32394	129	13	in	in	ADP
ajst-32394	129	14	the	the	DET
ajst-32394	129	15	development	development	NOUN
ajst-32394	129	16	of	of	ADP
ajst-32394	129	17	effective	effective	ADJ
ajst-32394	129	18	intervention	intervention	NOUN
ajst-32394	129	19	strategies	strategy	NOUN
ajst-32394	129	20	informed	inform	VERB
ajst-32394	129	21	by	by	ADP
ajst-32394	129	22	the	the	DET
ajst-32394	129	23	results	result	NOUN
ajst-32394	129	24	.	.	PUNCT
ajst-32394	130	1	by	by	ADP
ajst-32394	130	2	operating	operate	VERB
ajst-32394	130	3	within	within	ADP
ajst-32394	130	4	the	the	DET
ajst-32394	130	5	adverse	adverse	ADJ
ajst-32394	130	6	outcome	outcome	NOUN
ajst-32394	130	7	pathway	pathway	NOUN
ajst-32394	130	8	(	(	PUNCT
ajst-32394	130	9	aop	aop	PROPN
ajst-32394	130	10	)	)	PUNCT
ajst-32394	130	11	framework	framework	NOUN
ajst-32394	130	12	,	,	PUNCT
ajst-32394	130	13	it	it	PRON
ajst-32394	130	14	enables	enable	VERB
ajst-32394	130	15	a	a	DET
ajst-32394	130	16	thorough	thorough	ADJ
ajst-32394	130	17	tracing	tracing	NOUN
ajst-32394	130	18	of	of	ADP
ajst-32394	130	19	processes	process	NOUN
ajst-32394	130	20	from	from	ADP
ajst-32394	130	21	molecular	molecular	ADJ
ajst-32394	130	22	initiating	initiate	VERB
ajst-32394	130	23	events	event	NOUN
ajst-32394	130	24	(	(	PUNCT
ajst-32394	130	25	mies	mie	NOUN
ajst-32394	130	26	)	)	PUNCT
ajst-32394	130	27	to	to	PART
ajst-32394	130	28	terminal	terminal	VERB
ajst-32394	130	29	adverse	adverse	ADJ
ajst-32394	130	30	outcomes	outcome	NOUN
ajst-32394	130	31	.	.	PUNCT
ajst-32394	131	1	in	in	ADP
ajst-32394	131	2	the	the	DET
ajst-32394	131	3	field	field	NOUN
ajst-32394	131	4	of	of	ADP
ajst-32394	131	5	cytotoxicity	cytotoxicity	NOUN
ajst-32394	131	6	prediction	prediction	NOUN
ajst-32394	131	7	research	research	NOUN
ajst-32394	131	8	,	,	PUNCT
ajst-32394	131	9	deep	deep	ADJ
ajst-32394	131	10	learning	learning	NOUN
ajst-32394	131	11	models	model	NOUN
ajst-32394	131	12	facilitate	facilitate	VERB
ajst-32394	131	13	the	the	DET
ajst-32394	131	14	systematic	systematic	ADJ
ajst-32394	131	15	analysis	analysis	NOUN
ajst-32394	131	16	of	of	ADP
ajst-32394	131	17	extensive	extensive	ADJ
ajst-32394	131	18	chemical	chemical	NOUN
ajst-32394	131	19	databases	database	NOUN
ajst-32394	131	20	to	to	PART
ajst-32394	131	21	identify	identify	VERB
ajst-32394	131	22	recurring	recur	VERB
ajst-32394	131	23	toxicophores	toxicophore	NOUN
ajst-32394	131	24	,	,	PUNCT
ajst-32394	131	25	such	such	ADJ
ajst-32394	131	26	as	as	ADP
ajst-32394	131	27	epoxy	epoxy	NOUN
ajst-32394	131	28	or	or	CCONJ
ajst-32394	131	29	nitroaromatic	nitroaromatic	ADJ
ajst-32394	131	30	compounds	compound	NOUN
ajst-32394	131	31	,	,	PUNCT
ajst-32394	131	32	which	which	PRON
ajst-32394	131	33	are	be	AUX
ajst-32394	131	34	frequently	frequently	ADV
ajst-32394	131	35	associated	associate	VERB
ajst-32394	131	36	with	with	ADP
ajst-32394	131	37	cell	cell	NOUN
ajst-32394	131	38	membrane	membrane	NOUN
ajst-32394	131	39	lysis	lysis	NOUN
ajst-32394	131	40	or	or	CCONJ
ajst-32394	131	41	proteasome	proteasome	NOUN
ajst-32394	131	42	dysfunction	dysfunction	NOUN
ajst-32394	131	43	.	.	PUNCT
ajst-32394	132	1	utilizing	utilize	VERB
ajst-32394	132	2	a	a	DET
ajst-32394	132	3	proprietary	proprietary	ADJ
ajst-32394	132	4	dataset	dataset	NOUN
ajst-32394	132	5	of	of	ADP
ajst-32394	132	6	34,000	34,000	NUM
ajst-32394	132	7	compounds	compound	NOUN
ajst-32394	132	8	,	,	PUNCT
ajst-32394	132	9	a	a	DET
ajst-32394	132	10	convolutional	convolutional	ADJ
ajst-32394	132	11	neural	neural	ADJ
ajst-32394	132	12	network	network	NOUN
ajst-32394	132	13	(	(	PUNCT
ajst-32394	132	14	cnn	cnn	PROPN
ajst-32394	132	15	)	)	PUNCT
ajst-32394	132	16	achieved	achieve	VERB
ajst-32394	132	17	a	a	DET
ajst-32394	132	18	balanced	balanced	ADJ
ajst-32394	132	19	accuracy	accuracy	NOUN
ajst-32394	132	20	exceeding	exceed	VERB
ajst-32394	132	21	70	70	NUM
ajst-32394	132	22	%	%	NOUN
ajst-32394	132	23	in	in	ADP
ajst-32394	132	24	classifying	classify	VERB
ajst-32394	132	25	cytotoxicity	cytotoxicity	NOUN
ajst-32394	132	26	.	.	PUNCT
ajst-32394	133	1	this	this	DET
ajst-32394	133	2	methodology	methodology	NOUN
ajst-32394	133	3	further	far	ADV
ajst-32394	133	4	incorporates	incorporate	VERB
ajst-32394	133	5	deep	deep	ADJ
ajst-32394	133	6	taylor	taylor	PROPN
ajst-32394	133	7	decomposition	decomposition	NOUN
ajst-32394	133	8	(	(	PUNCT
ajst-32394	133	9	dtd	dtd	NOUN
ajst-32394	133	10	)	)	PUNCT
ajst-32394	133	11	to	to	PART
ajst-32394	133	12	retrospectively	retrospectively	ADV
ajst-32394	133	13	trace	trace	VERB
ajst-32394	133	14	atomic	atomic	ADJ
ajst-32394	133	15	-	-	PUNCT
ajst-32394	133	16	level	level	NOUN
ajst-32394	133	17	contributions	contribution	NOUN
ajst-32394	133	18	,	,	PUNCT
ajst-32394	133	19	producing	produce	VERB
ajst-32394	133	20	visual	visual	ADJ
ajst-32394	133	21	"	"	PUNCT
ajst-32394	133	22	cytotoxicity	cytotoxicity	NOUN
ajst-32394	133	23	maps	map	NOUN
ajst-32394	133	24	"	"	PUNCT
ajst-32394	133	25	that	that	PRON
ajst-32394	133	26	highlight	highlight	VERB
ajst-32394	133	27	electrophilic	electrophilic	ADJ
ajst-32394	133	28	reaction	reaction	NOUN
ajst-32394	133	29	centers	center	NOUN
ajst-32394	133	30	[	[	X
ajst-32394	133	31	46	46	NUM
ajst-32394	133	32	,	,	PUNCT
ajst-32394	133	33	47	47	NUM
ajst-32394	133	34	]	]	PUNCT
ajst-32394	133	35	.	.	PUNCT
ajst-32394	134	1	these	these	DET
ajst-32394	134	2	saliency	saliency	NOUN
ajst-32394	134	3	maps	map	NOUN
ajst-32394	134	4	are	be	AUX
ajst-32394	134	5	functionally	functionally	ADV
ajst-32394	134	6	comparable	comparable	ADJ
ajst-32394	134	7	to	to	ADP
ajst-32394	134	8	grad	grad	NOUN
ajst-32394	134	9	-	-	PUNCT
ajst-32394	134	10	cam	cam	NOUN
ajst-32394	134	11	in	in	ADP
ajst-32394	134	12	image	image	NOUN
ajst-32394	134	13	analysis	analysis	NOUN
ajst-32394	134	14	,	,	PUNCT
ajst-32394	134	15	significantly	significantly	ADV
ajst-32394	134	16	enhancing	enhance	VERB
ajst-32394	134	17	the	the	DET
ajst-32394	134	18	interpretability	interpretability	NOUN
ajst-32394	134	19	of	of	ADP
ajst-32394	134	20	the	the	DET
ajst-32394	134	21	model	model	NOUN
ajst-32394	134	22	by	by	ADP
ajst-32394	134	23	making	make	VERB
ajst-32394	134	24	predictions	prediction	NOUN
ajst-32394	134	25	more	more	ADV
ajst-32394	134	26	intuitive	intuitive	ADJ
ajst-32394	134	27	and	and	CCONJ
ajst-32394	134	28	identifying	identify	VERB
ajst-32394	134	29	molecular	molecular	ADJ
ajst-32394	134	30	fragments	fragment	NOUN
ajst-32394	134	31	amenable	amenable	ADJ
ajst-32394	134	32	to	to	ADP
ajst-32394	134	33	structural	structural	ADJ
ajst-32394	134	34	modification	modification	NOUN
ajst-32394	134	35	during	during	ADP
ajst-32394	134	36	lead	lead	ADJ
ajst-32394	134	37	optimization	optimization	NOUN
ajst-32394	134	38	.	.	PUNCT
ajst-32394	135	1	recent	recent	ADJ
ajst-32394	135	2	2025	2025	NUM
ajst-32394	135	3	extensions	extension	NOUN
ajst-32394	135	4	,	,	PUNCT
ajst-32394	135	5	per	per	ADP
ajst-32394	135	6	frontiers	frontier	NOUN
ajst-32394	135	7	'	'	PART
ajst-32394	135	8	ai	ai	NOUN
ajst-32394	135	9	-	-	PUNCT
ajst-32394	135	10	toxicity	toxicity	NOUN
ajst-32394	135	11	discourse	discourse	NOUN
ajst-32394	135	12	,	,	PUNCT
ajst-32394	135	13	infuse	infuse	VERB
ajst-32394	135	14	graph	graph	NOUN
ajst-32394	135	15	attention	attention	NOUN
ajst-32394	135	16	networks	network	NOUN
ajst-32394	135	17	(	(	PUNCT
ajst-32394	135	18	gats	gat	NOUN
ajst-32394	135	19	)	)	PUNCT
ajst-32394	135	20	to	to	PART
ajst-32394	135	21	encode	encode	VERB
ajst-32394	135	22	stereoelectronic	stereoelectronic	ADJ
ajst-32394	135	23	contexts	contexts	NOUN
ajst-32394	135	24	,	,	PUNCT
ajst-32394	135	25	unmasking	unmask	VERB
ajst-32394	135	26	solvent	solvent	NOUN
ajst-32394	135	27	-	-	PUNCT
ajst-32394	135	28	exposed	expose	VERB
ajst-32394	135	29	halogens	halogen	NOUN
ajst-32394	135	30	as	as	ADP
ajst-32394	135	31	necroptosis	necroptosis	NOUN
ajst-32394	135	32	inducers	inducer	NOUN
ajst-32394	135	33	in	in	ADP
ajst-32394	135	34	hepatocytes	hepatocyte	NOUN
ajst-32394	135	35	,	,	PUNCT
ajst-32394	135	36	thereby	thereby	ADV
ajst-32394	135	37	refining	refine	VERB
ajst-32394	135	38	qsars	qsar	NOUN
ajst-32394	135	39	for	for	ADP
ajst-32394	135	40	reactive	reactive	ADJ
ajst-32394	135	41	metabolites	metabolite	NOUN
ajst-32394	135	42	[	[	X
ajst-32394	135	43	48	48	NUM
ajst-32394	135	44	]	]	PUNCT
ajst-32394	135	45	.	.	PUNCT
ajst-32394	136	1	such	such	ADJ
ajst-32394	136	2	xai	xai	PROPN
ajst-32394	136	3	tools	tool	NOUN
ajst-32394	136	4	empower	empower	NOUN
ajst-32394	136	5	toxicologists	toxicologist	NOUN
ajst-32394	136	6	to	to	PART
ajst-32394	136	7	ablate	ablate	NOUN
ajst-32394	136	8	alerts	alert	NOUN
ajst-32394	136	9	preemptively	preemptively	ADV
ajst-32394	136	10	,	,	PUNCT
ajst-32394	136	11	curtailing	curtail	VERB
ajst-32394	136	12	attrition	attrition	NOUN
ajst-32394	136	13	where	where	SCONJ
ajst-32394	136	14	off	off	ADP
ajst-32394	136	15	-	-	PUNCT
ajst-32394	136	16	target	target	NOUN
ajst-32394	136	17	reactivities	reactivity	NOUN
ajst-32394	136	18	claim	claim	VERB
ajst-32394	136	19	30	30	NUM
ajst-32394	136	20	%	%	NOUN
ajst-32394	136	21	of	of	ADP
ajst-32394	136	22	candidates	candidate	NOUN
ajst-32394	136	23	.	.	PUNCT
ajst-32394	137	1	drug	drug	NOUN
ajst-32394	137	2	-	-	PUNCT
ajst-32394	137	3	induced	induce	VERB
ajst-32394	137	4	liver	liver	NOUN
ajst-32394	137	5	injury	injury	NOUN
ajst-32394	137	6	(	(	PUNCT
ajst-32394	137	7	dili	dili	PROPN
ajst-32394	137	8	)	)	PUNCT
ajst-32394	137	9	,	,	PUNCT
ajst-32394	137	10	a	a	DET
ajst-32394	137	11	sentinel	sentinel	NOUN
ajst-32394	137	12	for	for	ADP
ajst-32394	137	13	hepatotoxicity	hepatotoxicity	NOUN
ajst-32394	137	14	,	,	PUNCT
ajst-32394	137	15	benefits	benefit	NOUN
ajst-32394	137	16	from	from	ADP
ajst-32394	137	17	entropy	entropy	NOUN
ajst-32394	137	18	-	-	PUNCT
ajst-32394	137	19	weighted	weight	VERB
ajst-32394	137	20	multi	multi	ADJ
ajst-32394	137	21	-	-	ADJ
ajst-32394	137	22	omics	omics	ADJ
ajst-32394	137	23	integration	integration	NOUN
ajst-32394	137	24	,	,	PUNCT
ajst-32394	137	25	harmonizing	harmonize	VERB
ajst-32394	137	26	gene	gene	NOUN
ajst-32394	137	27	expression	expression	NOUN
ajst-32394	137	28	,	,	PUNCT
ajst-32394	137	29	pharmacovigilance	pharmacovigilance	NOUN
ajst-32394	137	30	labels	label	NOUN
ajst-32394	137	31	,	,	PUNCT
ajst-32394	137	32	and	and	CCONJ
ajst-32394	137	33	clinical	clinical	ADJ
ajst-32394	137	34	vignettes	vignette	NOUN
ajst-32394	137	35	into	into	ADP
ajst-32394	137	36	a	a	DET
ajst-32394	137	37	unified	unified	ADJ
ajst-32394	137	38	manifold	manifold	NOUN
ajst-32394	137	39	.	.	PUNCT
ajst-32394	138	1	the	the	DET
ajst-32394	138	2	xgboot	xgboot	PROPN
ajst-32394	138	3	-	-	PUNCT
ajst-32394	138	4	shap	shap	PROPN
ajst-32394	138	5	ensemble	ensemble	ADJ
ajst-32394	138	6	—	—	PUNCT
ajst-32394	138	7	gradient	gradient	ADJ
ajst-32394	138	8	boosting	boosting	NOUN
ajst-32394	138	9	laced	lace	VERB
ajst-32394	138	10	with	with	ADP
ajst-32394	138	11	shapley	shapley	ADJ
ajst-32394	138	12	values	value	NOUN
ajst-32394	138	13	—	—	PUNCT
ajst-32394	138	14	ranks	rank	VERB
ajst-32394	138	15	11	11	NUM
ajst-32394	138	16	pathways	pathway	NOUN
ajst-32394	138	17	,	,	PUNCT
ajst-32394	138	18	from	from	ADP
ajst-32394	138	19	xenobiotic	xenobiotic	ADJ
ajst-32394	138	20	metabolism	metabolism	NOUN
ajst-32394	138	21	to	to	PART
ajst-32394	138	22	bile	bile	VERB
ajst-32394	138	23	acid	acid	NOUN
ajst-32394	138	24	flux	flux	NOUN
ajst-32394	138	25	,	,	PUNCT
ajst-32394	138	26	attaining	attain	VERB
ajst-32394	138	27	≥86	≥86	X
ajst-32394	138	28	%	%	NOUN
ajst-32394	138	29	precision	precision	NOUN
ajst-32394	138	30	in	in	ADP
ajst-32394	138	31	stratifying	stratify	VERB
ajst-32394	138	32	injured	injure	VERB
ajst-32394	138	33	cohorts	cohort	NOUN
ajst-32394	138	34	[	[	X
ajst-32394	138	35	49	49	NUM
ajst-32394	138	36	]	]	PUNCT
ajst-32394	138	37	.	.	PUNCT
ajst-32394	139	1	shap	shap	PROPN
ajst-32394	139	2	waterfalls	waterfall	NOUN
ajst-32394	139	3	elucidate	elucidate	VERB
ajst-32394	139	4	compound	compound	NOUN
ajst-32394	139	5	-	-	PUNCT
ajst-32394	139	6	specific	specific	ADJ
ajst-32394	139	7	drivers	driver	NOUN
ajst-32394	139	8	,	,	PUNCT
ajst-32394	139	9	e.g.	e.g.	ADV
ajst-32394	139	10	,	,	PUNCT
ajst-32394	139	11	troglitazone	troglitazone	NOUN
ajst-32394	139	12	's	's	PART
ajst-32394	139	13	mitochondrial	mitochondrial	ADJ
ajst-32394	139	14	uncoupling	uncoupling	NOUN
ajst-32394	139	15	via	via	ADP
ajst-32394	139	16	ugt1a1	ugt1a1	ADJ
ajst-32394	139	17	inhibition	inhibition	NOUN
ajst-32394	139	18	,	,	PUNCT
ajst-32394	139	19	while	while	SCONJ
ajst-32394	139	20	global	global	ADJ
ajst-32394	139	21	attributions	attribution	NOUN
ajst-32394	139	22	nominate	nominate	VERB
ajst-32394	139	23	nrf2	nrf2	NOUN
ajst-32394	139	24	activation	activation	NOUN
ajst-32394	139	25	as	as	ADP
ajst-32394	139	26	a	a	DET
ajst-32394	139	27	pan	pan	ADJ
ajst-32394	139	28	-	-	ADJ
ajst-32394	139	29	dili	dili	ADJ
ajst-32394	139	30	mitigator	mitigator	NOUN
ajst-32394	139	31	.	.	PUNCT
ajst-32394	140	1	bai	bai	PROPN
ajst-32394	140	2	's	's	PART
ajst-32394	140	3	2025	2025	NUM
ajst-32394	140	4	analysis	analysis	NOUN
ajst-32394	140	5	corroborates	corroborate	VERB
ajst-32394	140	6	this	this	PRON
ajst-32394	140	7	,	,	PUNCT
ajst-32394	140	8	benchmarking	benchmarke	VERB
ajst-32394	140	9	xgb	xgb	NOUN
ajst-32394	140	10	against	against	ADP
ajst-32394	140	11	dl	dl	PROPN
ajst-32394	140	12	variants	variant	NOUN
ajst-32394	140	13	across	across	ADP
ajst-32394	140	14	dili	dili	PROPN
ajst-32394	140	15	subtypes	subtype	NOUN
ajst-32394	140	16	,	,	PUNCT
ajst-32394	140	17	where	where	SCONJ
ajst-32394	140	18	attention	attention	NOUN
ajst-32394	140	19	mechanisms	mechanism	VERB
ajst-32394	140	20	unveil	unveil	VERB
ajst-32394	140	21	idiosyncratic	idiosyncratic	ADJ
ajst-32394	140	22	triggers	trigger	NOUN
ajst-32394	140	23	like	like	ADP
ajst-32394	140	24	hla	hla	NOUN
ajst-32394	140	25	-	-	PUNCT
ajst-32394	140	26	b*57:01	b*57:01	VERB
ajst-32394	140	27	haplotypes	haplotype	NOUN
ajst-32394	140	28	in	in	ADP
ajst-32394	140	29	flucloxacillin	flucloxacillin	PROPN
ajst-32394	140	30	hypersensitivity	hypersensitivity	NOUN
ajst-32394	140	31	.	.	PUNCT
ajst-32394	141	1	therapeutically	therapeutically	ADV
ajst-32394	141	2	,	,	PUNCT
ajst-32394	141	3	these	these	DET
ajst-32394	141	4	insights	insight	NOUN
ajst-32394	141	5	propel	propel	VERB
ajst-32394	141	6	precision	precision	NOUN
ajst-32394	141	7	prophylaxis	prophylaxis	NOUN
ajst-32394	141	8	,	,	PUNCT
ajst-32394	141	9	as	as	ADP
ajst-32394	141	10	in	in	ADP
ajst-32394	141	11	cyp3a4	cyp3a4	PROPN
ajst-32394	141	12	phenotyping	phenotype	VERB
ajst-32394	141	13	to	to	PART
ajst-32394	141	14	avert	avert	VERB
ajst-32394	141	15	steatotic	steatotic	ADJ
ajst-32394	141	16	cascades	cascade	NOUN
ajst-32394	141	17	.	.	PUNCT
ajst-32394	142	1	for	for	ADP
ajst-32394	142	2	drug	drug	NOUN
ajst-32394	142	3	-	-	PUNCT
ajst-32394	142	4	induced	induce	VERB
ajst-32394	142	5	autoimmunity	autoimmunity	NOUN
ajst-32394	142	6	(	(	PUNCT
ajst-32394	142	7	dia	dia	PROPN
ajst-32394	142	8	)	)	PUNCT
ajst-32394	142	9	,	,	PUNCT
ajst-32394	142	10	the	the	DET
ajst-32394	142	11	interdia	interdia	NOUN
ajst-32394	142	12	framework	framework	NOUN
ajst-32394	142	13	deploys	deploy	VERB
ajst-32394	142	14	multi	multi	ADJ
ajst-32394	142	15	-	-	ADJ
ajst-32394	142	16	strategy	strategy	ADJ
ajst-32394	142	17	feature	feature	NOUN
ajst-32394	142	18	selection	selection	NOUN
ajst-32394	142	19	—	—	PUNCT
ajst-32394	142	20	recursive	recursive	ADJ
ajst-32394	142	21	elimination	elimination	NOUN
ajst-32394	142	22	with	with	ADP
ajst-32394	142	23	lasso	lasso	NOUN
ajst-32394	142	24	—	—	PUNCT
ajst-32394	142	25	and	and	CCONJ
ajst-32394	142	26	ensemble	ensemble	ADJ
ajst-32394	142	27	resampling	resampling	NOUN
ajst-32394	142	28	to	to	PART
ajst-32394	142	29	forecast	forecast	VERB
ajst-32394	142	30	hypersensitivity	hypersensitivity	NOUN
ajst-32394	142	31	syndromes	syndrome	NOUN
ajst-32394	142	32	like	like	ADP
ajst-32394	142	33	stevens	stevens	PROPN
ajst-32394	142	34	-	-	PUNCT
ajst-32394	142	35	johnson	johnson	PROPN
ajst-32394	142	36	.	.	PUNCT
ajst-32394	143	1	the	the	DET
ajst-32394	143	2	optimized	optimize	VERB
ajst-32394	143	3	easy	easy	ADJ
ajst-32394	143	4	ensemble	ensemble	ADJ
ajst-32394	143	5	classifier	classifier	NOUN
ajst-32394	143	6	registers	register	VERB
ajst-32394	143	7	0.8836	0.8836	NUM
ajst-32394	143	8	auc	auc	NOUN
ajst-32394	143	9	in	in	ADP
ajst-32394	143	10	cross	cross	ADJ
ajst-32394	143	11	-	-	ADJ
ajst-32394	143	12	validation	validation	ADJ
ajst-32394	143	13	and	and	CCONJ
ajst-32394	143	14	0.8930	0.8930	NUM
ajst-32394	143	15	externally	externally	ADV
ajst-32394	143	16	,	,	PUNCT
ajst-32394	143	17	with	with	ADP
ajst-32394	143	18	82	82	NUM
ajst-32394	143	19	-	-	SYM
ajst-32394	143	20	85	85	NUM
ajst-32394	143	21	%	%	NOUN
ajst-32394	143	22	accuracies	accuracy	NOUN
ajst-32394	143	23	,	,	PUNCT
ajst-32394	143	24	outpacing	outpace	VERB
ajst-32394	143	25	baselines	baseline	NOUN
ajst-32394	143	26	by	by	ADP
ajst-32394	143	27	inputting	inputte	VERB
ajst-32394	143	28	physicochemical	physicochemical	ADJ
ajst-32394	143	29	determinants	determinant	NOUN
ajst-32394	143	30	via	via	ADP
ajst-32394	143	31	shap	shap	NOUN
ajst-32394	143	32	:	:	PUNCT
ajst-32394	143	33	lipophilicity	lipophilicity	NOUN
ajst-32394	143	34	(	(	PUNCT
ajst-32394	143	35	logp	logp	NOUN
ajst-32394	143	36	>	>	NOUN
ajst-32394	143	37	3	3	NUM
ajst-32394	143	38	)	)	PUNCT
ajst-32394	143	39	,	,	PUNCT
ajst-32394	143	40	charge	charge	NOUN
ajst-32394	143	41	asymmetries	asymmetry	NOUN
ajst-32394	143	42	,	,	PUNCT
ajst-32394	143	43	and	and	CCONJ
ajst-32394	143	44	topological	topological	ADJ
ajst-32394	143	45	polar	polar	ADJ
ajst-32394	143	46	surfaces	surface	NOUN
ajst-32394	143	47	steering	steer	VERB
ajst-32394	143	48	hla	hla	PROPN
ajst-32394	143	49	cross	cross	NOUN
ajst-32394	143	50	-	-	NOUN
ajst-32394	143	51	reactivity	reactivity	NOUN
ajst-32394	143	52	[	[	X
ajst-32394	143	53	50	50	NUM
ajst-32394	143	54	]	]	PUNCT
ajst-32394	143	55	.	.	PUNCT
ajst-32394	144	1	mechanistically	mechanistically	ADV
ajst-32394	144	2	,	,	PUNCT
ajst-32394	144	3	these	these	PRON
ajst-32394	144	4	link	link	VERB
ajst-32394	144	5	to	to	ADP
ajst-32394	144	6	t	t	NOUN
ajst-32394	144	7	-	-	PUNCT
ajst-32394	144	8	cell	cell	NOUN
ajst-32394	144	9	epitopes	epitope	NOUN
ajst-32394	144	10	,	,	PUNCT
ajst-32394	144	11	as	as	ADP
ajst-32394	144	12	in	in	ADP
ajst-32394	144	13	carbamazepine	carbamazepine	NOUN
ajst-32394	144	14	's	's	PART
ajst-32394	144	15	aromatic	aromatic	ADJ
ajst-32394	144	16	ring	ring	NOUN
ajst-32394	144	17	fostering	foster	VERB
ajst-32394	144	18	peptide	peptide	NOUN
ajst-32394	144	19	mimicry	mimicry	NOUN
ajst-32394	144	20	.	.	PUNCT
ajst-32394	145	1	2025	2025	NUM
ajst-32394	145	2	's	's	PART
ajst-32394	145	3	interpretable	interpretable	ADJ
ajst-32394	145	4	dl	dl	PROPN
ajst-32394	145	5	horizons	horizon	NOUN
ajst-32394	145	6	,	,	PUNCT
ajst-32394	145	7	per	per	ADP
ajst-32394	145	8	acs	acs	PROPN
ajst-32394	145	9	's	's	PART
ajst-32394	145	10	computational	computational	ADJ
ajst-32394	145	11	tox	tox	NOUN
ajst-32394	145	12	review	review	NOUN
ajst-32394	145	13	,	,	PUNCT
ajst-32394	145	14	extend	extend	VERB
ajst-32394	145	15	this	this	PRON
ajst-32394	145	16	via	via	ADP
ajst-32394	145	17	counterfactuals	counterfactual	NOUN
ajst-32394	145	18	,	,	PUNCT
ajst-32394	145	19	simulating	simulate	VERB
ajst-32394	145	20	"	"	PUNCT
ajst-32394	145	21	what	what	PRON
ajst-32394	145	22	-	-	PUNCT
ajst-32394	145	23	if	if	SCONJ
ajst-32394	145	24	"	"	PUNCT
ajst-32394	145	25	mutations	mutation	NOUN
ajst-32394	145	26	to	to	PART
ajst-32394	145	27	abrogate	abrogate	VERB
ajst-32394	145	28	autoantigenicity	autoantigenicity	NOUN
ajst-32394	145	29	,	,	PUNCT
ajst-32394	145	30	nominating	nominating	NOUN
ajst-32394	145	31	safer	safe	ADJ
ajst-32394	145	32	arylamine	arylamine	NOUN
ajst-32394	145	33	scaffolds	scaffold	NOUN
ajst-32394	145	34	[	[	X
ajst-32394	145	35	51	51	NUM
ajst-32394	145	36	]	]	PUNCT
ajst-32394	145	37	.	.	PUNCT
ajst-32394	146	1	208	208	NUM
ajst-32394	146	2	8	8	NUM
ajst-32394	146	3	.	.	PUNCT
ajst-32394	146	4	machine	machine	NOUN
ajst-32394	146	5	learning	learn	VERB
ajst-32394	146	6	for	for	ADP
ajst-32394	146	7	toxicological	toxicological	ADJ
ajst-32394	146	8	biomarker	biomarker	NOUN
ajst-32394	146	9	discovery	discovery	NOUN
ajst-32394	146	10	machine	machine	NOUN
ajst-32394	146	11	learning	learning	NOUN
ajst-32394	146	12	(	(	PUNCT
ajst-32394	146	13	ml	ml	NOUN
ajst-32394	146	14	)	)	PUNCT
ajst-32394	146	15	stands	stand	VERB
ajst-32394	146	16	as	as	ADP
ajst-32394	146	17	a	a	DET
ajst-32394	146	18	transformative	transformative	ADJ
ajst-32394	146	19	force	force	NOUN
ajst-32394	146	20	in	in	ADP
ajst-32394	146	21	toxicological	toxicological	ADJ
ajst-32394	146	22	biomarker	biomarker	NOUN
ajst-32394	146	23	discovery	discovery	NOUN
ajst-32394	146	24	,	,	PUNCT
ajst-32394	146	25	harnessing	harness	VERB
ajst-32394	146	26	high	high	ADJ
ajst-32394	146	27	-	-	PUNCT
ajst-32394	146	28	dimensional	dimensional	ADJ
ajst-32394	146	29	omics	omic	NOUN
ajst-32394	146	30	and	and	CCONJ
ajst-32394	146	31	phenotypic	phenotypic	ADJ
ajst-32394	146	32	data	datum	NOUN
ajst-32394	146	33	to	to	PART
ajst-32394	146	34	pinpoint	pinpoint	VERB
ajst-32394	146	35	molecular	molecular	ADJ
ajst-32394	146	36	sentinels	sentinel	NOUN
ajst-32394	146	37	of	of	ADP
ajst-32394	146	38	toxicity	toxicity	NOUN
ajst-32394	146	39	,	,	PUNCT
ajst-32394	146	40	thereby	thereby	ADV
ajst-32394	146	41	facilitating	facilitate	VERB
ajst-32394	146	42	early	early	ADJ
ajst-32394	146	43	detection	detection	NOUN
ajst-32394	146	44	,	,	PUNCT
ajst-32394	146	45	mechanistic	mechanistic	ADJ
ajst-32394	146	46	probing	probing	NOUN
ajst-32394	146	47	,	,	PUNCT
ajst-32394	146	48	and	and	CCONJ
ajst-32394	146	49	therapeutic	therapeutic	ADJ
ajst-32394	146	50	stratification	stratification	NOUN
ajst-32394	146	51	[	[	X
ajst-32394	146	52	52	52	NUM
ajst-32394	146	53	]	]	PUNCT
ajst-32394	146	54	.	.	PUNCT
ajst-32394	147	1	this	this	DET
ajst-32394	147	2	paradigm	paradigm	NOUN
ajst-32394	147	3	shift	shift	NOUN
ajst-32394	147	4	,	,	PUNCT
ajst-32394	147	5	as	as	SCONJ
ajst-32394	147	6	tonoyan	tonoyan	NOUN
ajst-32394	147	7	and	and	CCONJ
ajst-32394	147	8	siraki	siraki	ADV
ajst-32394	147	9	delineate	delineate	VERB
ajst-32394	147	10	in	in	ADP
ajst-32394	147	11	their	their	PRON
ajst-32394	147	12	2024	2024	NUM
ajst-32394	147	13	-	-	SYM
ajst-32394	147	14	2025	2025	NUM
ajst-32394	147	15	synthesis	synthesis	NOUN
ajst-32394	147	16	,	,	PUNCT
ajst-32394	147	17	extends	extend	VERB
ajst-32394	147	18	to	to	ADP
ajst-32394	147	19	predictive	predictive	ADJ
ajst-32394	147	20	toxicokinetics	toxicokinetic	NOUN
ajst-32394	147	21	and	and	CCONJ
ajst-32394	147	22	xenobiotic	xenobiotic	ADJ
ajst-32394	147	23	responses	response	NOUN
ajst-32394	147	24	,	,	PUNCT
ajst-32394	147	25	where	where	SCONJ
ajst-32394	147	26	hidden	hide	VERB
ajst-32394	147	27	markov	markov	NOUN
ajst-32394	147	28	models	model	NOUN
ajst-32394	147	29	(	(	PUNCT
ajst-32394	147	30	hmms	hmms	NOUN
ajst-32394	147	31	)	)	PUNCT
ajst-32394	147	32	unearth	unearth	ADJ
ajst-32394	147	33	temporal	temporal	ADJ
ajst-32394	147	34	signatures	signature	NOUN
ajst-32394	147	35	in	in	ADP
ajst-32394	147	36	metabolomic	metabolomic	ADJ
ajst-32394	147	37	fluxes	flux	NOUN
ajst-32394	147	38	,	,	PUNCT
ajst-32394	147	39	nominating	nominating	NOUN
ajst-32394	147	40	biomarkers	biomarker	NOUN
ajst-32394	147	41	for	for	ADP
ajst-32394	147	42	organ	organ	NOUN
ajst-32394	147	43	-	-	PUNCT
ajst-32394	147	44	specific	specific	ADJ
ajst-32394	147	45	insults	insult	NOUN
ajst-32394	147	46	with	with	ADP
ajst-32394	147	47	accuracies	accuracy	NOUN
ajst-32394	147	48	surpassing	surpass	VERB
ajst-32394	147	49	80	80	NUM
ajst-32394	147	50	%	%	NOUN
ajst-32394	147	51	[	[	X
ajst-32394	147	52	53	53	NUM
ajst-32394	147	53	]	]	PUNCT
ajst-32394	147	54	.	.	PUNCT
ajst-32394	148	1	the	the	DET
ajst-32394	148	2	multiflow	multiflow	PROPN
ajst-32394	148	3	®	®	PROPN
ajst-32394	148	4	dna	dna	NOUN
ajst-32394	148	5	damage	damage	NOUN
ajst-32394	148	6	assay	assay	NOUN
ajst-32394	148	7	exemplifies	exemplify	VERB
ajst-32394	148	8	ml	ml	PART
ajst-32394	148	9	’s	’s	PART
ajst-32394	148	10	diagnostic	diagnostic	ADJ
ajst-32394	148	11	finesse	finesse	NOUN
ajst-32394	148	12	,	,	PUNCT
ajst-32394	148	13	interrogating	interrogate	VERB
ajst-32394	148	14	multiplexed	multiplexed	ADJ
ajst-32394	148	15	flow	flow	NOUN
ajst-32394	148	16	cytometry	cytometry	NOUN
ajst-32394	148	17	readouts	readout	NOUN
ajst-32394	148	18	from	from	ADP
ajst-32394	148	19	tk6	tk6	NOUN
ajst-32394	148	20	cells	cell	NOUN
ajst-32394	148	21	exposed	expose	VERB
ajst-32394	148	22	to	to	ADP
ajst-32394	148	23	103	103	NUM
ajst-32394	148	24	chemicals	chemical	NOUN
ajst-32394	148	25	.	.	PUNCT
ajst-32394	149	1	three	three	NUM
ajst-32394	149	2	archetypes	archetype	NOUN
ajst-32394	149	3	—	—	PUNCT
ajst-32394	149	4	random	random	ADJ
ajst-32394	149	5	forest	forest	NOUN
ajst-32394	149	6	,	,	PUNCT
ajst-32394	149	7	logistic	logistic	ADJ
ajst-32394	149	8	regression	regression	NOUN
ajst-32394	149	9	,	,	PUNCT
ajst-32394	149	10	and	and	CCONJ
ajst-32394	149	11	artificial	artificial	ADJ
ajst-32394	149	12	neural	neural	ADJ
ajst-32394	149	13	networks	network	NOUN
ajst-32394	149	14	—	—	PUNCT
ajst-32394	149	15	trained	train	VERB
ajst-32394	149	16	on	on	ADP
ajst-32394	149	17	85	85	NUM
ajst-32394	149	18	antecedent	antecedent	NOUN
ajst-32394	149	19	compounds	compound	NOUN
ajst-32394	149	20	,	,	PUNCT
ajst-32394	149	21	prognosticate	prognosticate	ADJ
ajst-32394	149	22	genotoxic	genotoxic	ADJ
ajst-32394	149	23	modes	mode	NOUN
ajst-32394	149	24	with	with	ADP
ajst-32394	149	25	accuracies	accuracy	NOUN
ajst-32394	149	26	of	of	ADP
ajst-32394	149	27	79.6	79.6	NUM
ajst-32394	149	28	-	-	SYM
ajst-32394	149	29	90.7	90.7	NUM
ajst-32394	149	30	%	%	NOUN
ajst-32394	149	31	;	;	PUNCT
ajst-32394	149	32	a	a	DET
ajst-32394	149	33	majority	majority	NOUN
ajst-32394	149	34	-	-	PUNCT
ajst-32394	149	35	vote	vote	NOUN
ajst-32394	149	36	ensemble	ensemble	ADJ
ajst-32394	149	37	elevates	elevate	VERB
ajst-32394	149	38	this	this	PRON
ajst-32394	149	39	to	to	ADP
ajst-32394	149	40	92.6	92.6	NUM
ajst-32394	149	41	%	%	NOUN
ajst-32394	149	42	,	,	PUNCT
ajst-32394	149	43	generalizing	generalize	VERB
ajst-32394	149	44	across	across	ADP
ajst-32394	149	45	aneugens	aneugen	NOUN
ajst-32394	149	46	,	,	PUNCT
ajst-32394	149	47	clastogens	clastogens	PROPN
ajst-32394	149	48	,	,	PUNCT
ajst-32394	149	49	and	and	CCONJ
ajst-32394	149	50	non	non	NOUN
ajst-32394	149	51	-	-	ADJ
ajst-32394	149	52	genotoxins	genotoxin	NOUN
ajst-32394	149	53	[	[	X
ajst-32394	149	54	54	54	NUM
ajst-32394	149	55	]	]	PUNCT
ajst-32394	149	56	.	.	PUNCT
ajst-32394	150	1	in	in	ADP
ajst-32394	150	2	smoke	smoke	NOUN
ajst-32394	150	3	exposure	exposure	NOUN
ajst-32394	150	4	phenotyping	phenotyping	NOUN
ajst-32394	150	5	,	,	PUNCT
ajst-32394	150	6	ml	ml	ADP
ajst-32394	150	7	ensembles	ensemble	NOUN
ajst-32394	150	8	forge	forge	ADJ
ajst-32394	150	9	gene	gene	NOUN
ajst-32394	150	10	signatures	signature	NOUN
ajst-32394	150	11	resilient	resilient	ADJ
ajst-32394	150	12	to	to	PART
ajst-32394	150	13	batch	batch	VERB
ajst-32394	150	14	effects	effect	NOUN
ajst-32394	150	15	,	,	PUNCT
ajst-32394	150	16	merging	merge	VERB
ajst-32394	150	17	ranker	ranker	NOUN
ajst-32394	150	18	heuristics	heuristic	NOUN
ajst-32394	150	19	—	—	PUNCT
ajst-32394	150	20	relief	relief	NOUN
ajst-32394	150	21	-	-	PUNCT
ajst-32394	150	22	f	f	NOUN
ajst-32394	150	23	,	,	PUNCT
ajst-32394	150	24	information	information	NOUN
ajst-32394	150	25	gain	gain	NOUN
ajst-32394	150	26	—	—	PUNCT
ajst-32394	150	27	with	with	ADP
ajst-32394	150	28	off	off	ADP
ajst-32394	150	29	-	-	PUNCT
ajst-32394	150	30	the	the	DET
ajst-32394	150	31	-	-	PUNCT
ajst-32394	150	32	shelf	shelf	NOUN
ajst-32394	150	33	classifiers	classifier	NOUN
ajst-32394	150	34	like	like	ADP
ajst-32394	150	35	svms	svms	NOUN
ajst-32394	150	36	and	and	CCONJ
ajst-32394	150	37	neural	neural	ADJ
ajst-32394	150	38	nets	net	NOUN
ajst-32394	150	39	to	to	PART
ajst-32394	150	40	discriminate	discriminate	VERB
ajst-32394	150	41	active	active	ADJ
ajst-32394	150	42	smokers	smoker	NOUN
ajst-32394	150	43	from	from	ADP
ajst-32394	150	44	quitters	quitter	NOUN
ajst-32394	150	45	.	.	PUNCT
ajst-32394	151	1	from	from	ADP
ajst-32394	151	2	merged	merged	ADJ
ajst-32394	151	3	microarray	microarray	NOUN
ajst-32394	151	4	compendia	compendia	NOUN
ajst-32394	151	5	,	,	PUNCT
ajst-32394	151	6	six	six	NUM
ajst-32394	151	7	neoteric	neoteric	ADJ
ajst-32394	151	8	genes	gene	NOUN
ajst-32394	151	9	(	(	PUNCT
ajst-32394	151	10	e.g.	e.g.	ADV
ajst-32394	151	11	,	,	PUNCT
ajst-32394	151	12	ahrr	ahrr	ADJ
ajst-32394	151	13	,	,	PUNCT
ajst-32394	151	14	cgb	cgb	NOUN
ajst-32394	151	15	)	)	PUNCT
ajst-32394	151	16	surface	surface	NOUN
ajst-32394	151	17	in	in	ADP
ajst-32394	151	18	signatures	signature	NOUN
ajst-32394	151	19	prognosticating	prognosticate	VERB
ajst-32394	151	20	cessation	cessation	NOUN
ajst-32394	151	21	efficacy	efficacy	NOUN
ajst-32394	151	22	at	at	ADP
ajst-32394	151	23	85	85	NUM
ajst-32394	151	24	%	%	NOUN
ajst-32394	151	25	specificity	specificity	NOUN
ajst-32394	151	26	,	,	PUNCT
ajst-32394	151	27	validated	validate	VERB
ajst-32394	151	28	in	in	ADP
ajst-32394	151	29	independent	independent	ADJ
ajst-32394	151	30	cohorts	cohort	NOUN
ajst-32394	151	31	[	[	X
ajst-32394	151	32	55	55	NUM
ajst-32394	151	33	]	]	PUNCT
ajst-32394	151	34	.	.	PUNCT
ajst-32394	152	1	systems	system	NOUN
ajst-32394	152	2	toxicology	toxicology	NOUN
ajst-32394	152	3	paradigms	paradigm	VERB
ajst-32394	152	4	further	far	ADV
ajst-32394	152	5	illuminate	illuminate	VERB
ajst-32394	152	6	renal	renal	ADJ
ajst-32394	152	7	biomarkers	biomarker	NOUN
ajst-32394	152	8	,	,	PUNCT
ajst-32394	152	9	blending	blend	VERB
ajst-32394	152	10	high	high	ADJ
ajst-32394	152	11	-	-	PUNCT
ajst-32394	152	12	content	content	NOUN
ajst-32394	152	13	imaging	imaging	NOUN
ajst-32394	152	14	with	with	ADP
ajst-32394	152	15	transcriptomics	transcriptomic	NOUN
ajst-32394	152	16	from	from	ADP
ajst-32394	152	17	46	46	NUM
ajst-32394	152	18	nephrotoxins	nephrotoxin	NOUN
ajst-32394	152	19	.	.	PUNCT
ajst-32394	153	1	random	random	ADJ
ajst-32394	153	2	forest	forest	NOUN
ajst-32394	153	3	classifiers	classifier	NOUN
ajst-32394	153	4	prioritize	prioritize	VERB
ajst-32394	153	5	morphological	morphological	ADJ
ajst-32394	153	6	vignettes	vignette	NOUN
ajst-32394	153	7	—	—	PUNCT
ajst-32394	153	8	nuclear	nuclear	ADJ
ajst-32394	153	9	texture	texture	NOUN
ajst-32394	153	10	,	,	PUNCT
ajst-32394	153	11	cell	cell	NOUN
ajst-32394	153	12	area	area	NOUN
ajst-32394	153	13	—	—	PUNCT
ajst-32394	153	14	alongside	alongside	ADP
ajst-32394	153	15	hmox1	hmox1	NOUN
ajst-32394	153	16	and	and	CCONJ
ajst-32394	153	17	sqstm1	sqstm1	PROPN
ajst-32394	153	18	mrna	mrna	PROPN
ajst-32394	153	19	,	,	PUNCT
ajst-32394	153	20	attaining	attain	VERB
ajst-32394	153	21	88	88	NUM
ajst-32394	153	22	%	%	NOUN
ajst-32394	153	23	accuracy	accuracy	NOUN
ajst-32394	153	24	in	in	ADP
ajst-32394	153	25	prognosticating	prognosticate	VERB
ajst-32394	153	26	tubular	tubular	ADJ
ajst-32394	153	27	necrosis	necrosis	NOUN
ajst-32394	153	28	[	[	X
ajst-32394	153	29	56	56	NUM
ajst-32394	153	30	]	]	PUNCT
ajst-32394	153	31	.	.	PUNCT
ajst-32394	154	1	validated	validate	VERB
ajst-32394	154	2	against	against	ADP
ajst-32394	154	3	late	late	ADJ
ajst-32394	154	4	-	-	PUNCT
ajst-32394	154	5	stage	stage	NOUN
ajst-32394	154	6	failures	failure	NOUN
ajst-32394	154	7	like	like	ADP
ajst-32394	154	8	tenofovir	tenofovir	NOUN
ajst-32394	154	9	,	,	PUNCT
ajst-32394	154	10	these	these	DET
ajst-32394	154	11	panels	panel	NOUN
ajst-32394	154	12	forecast	forecast	VERB
ajst-32394	154	13	attrition	attrition	NOUN
ajst-32394	154	14	with	with	ADP
ajst-32394	154	15	75	75	NUM
ajst-32394	154	16	%	%	NOUN
ajst-32394	154	17	sensitivity	sensitivity	NOUN
ajst-32394	154	18	,	,	PUNCT
ajst-32394	154	19	circumventing	circumvent	VERB
ajst-32394	154	20	histopathological	histopathological	ADJ
ajst-32394	154	21	delays	delay	NOUN
ajst-32394	154	22	.	.	PUNCT
ajst-32394	155	1	as	as	SCONJ
ajst-32394	155	2	2025	2025	NUM
ajst-32394	155	3	reviews	review	NOUN
ajst-32394	155	4	in	in	ADP
ajst-32394	155	5	frontiers	frontier	NOUN
ajst-32394	155	6	affirm	affirm	NOUN
ajst-32394	155	7	,	,	PUNCT
ajst-32394	155	8	federated	federate	VERB
ajst-32394	155	9	learning	learning	NOUN
ajst-32394	155	10	on	on	ADP
ajst-32394	155	11	multi	multi	ADJ
ajst-32394	155	12	-	-	ADJ
ajst-32394	155	13	omics	omics	ADJ
ajst-32394	155	14	consortia	consortium	NOUN
ajst-32394	155	15	—	—	PUNCT
ajst-32394	155	16	e.g.	e.g.	ADV
ajst-32394	155	17	,	,	PUNCT
ajst-32394	155	18	open	open	ADJ
ajst-32394	155	19	tg	tg	NOUN
ajst-32394	155	20	-	-	PUNCT
ajst-32394	155	21	gates	gate	NOUN
ajst-32394	155	22	—	—	PUNCT
ajst-32394	155	23	amplifies	amplify	VERB
ajst-32394	155	24	this	this	PRON
ajst-32394	155	25	via	via	ADP
ajst-32394	155	26	graph	graph	NOUN
ajst-32394	155	27	convolutional	convolutional	ADJ
ajst-32394	155	28	nets	net	NOUN
ajst-32394	155	29	,	,	PUNCT
ajst-32394	155	30	nominating	nominating	NOUN
ajst-32394	155	31	autophagy	autophagy	ADJ
ajst-32394	155	32	flux	flux	NOUN
ajst-32394	155	33	(	(	PUNCT
ajst-32394	155	34	lc3b	lc3b	NOUN
ajst-32394	155	35	/	/	SYM
ajst-32394	155	36	lamp2	lamp2	NOUN
ajst-32394	155	37	ratios	ratio	NOUN
ajst-32394	155	38	)	)	PUNCT
ajst-32394	155	39	as	as	ADP
ajst-32394	155	40	pannephrotoxic	pannephrotoxic	ADJ
ajst-32394	155	41	harbingers	harbinger	NOUN
ajst-32394	155	42	,	,	PUNCT
ajst-32394	155	43	extensible	extensible	ADJ
ajst-32394	155	44	to	to	ADP
ajst-32394	155	45	aristolochic	aristolochic	ADJ
ajst-32394	155	46	acid	acid	NOUN
ajst-32394	155	47	nephropathy	nephropathy	NOUN
ajst-32394	155	48	[	[	X
ajst-32394	155	49	57	57	NUM
ajst-32394	155	50	]	]	PUNCT
ajst-32394	155	51	.	.	PUNCT
ajst-32394	156	1	9	9	X
ajst-32394	156	2	.	.	X
ajst-32394	156	3	toxicant	toxicant	ADJ
ajst-32394	156	4	detection	detection	NOUN
ajst-32394	156	5	and	and	CCONJ
ajst-32394	156	6	classification	classification	NOUN
ajst-32394	156	7	using	use	VERB
ajst-32394	156	8	machine	machine	NOUN
ajst-32394	156	9	learning	learn	VERB
ajst-32394	156	10	machine	machine	NOUN
ajst-32394	156	11	learning	learning	NOUN
ajst-32394	156	12	(	(	PUNCT
ajst-32394	156	13	ml	ml	NOUN
ajst-32394	156	14	)	)	PUNCT
ajst-32394	156	15	has	have	AUX
ajst-32394	156	16	revolutionized	revolutionize	VERB
ajst-32394	156	17	toxicant	toxicant	ADJ
ajst-32394	156	18	detection	detection	NOUN
ajst-32394	156	19	and	and	CCONJ
ajst-32394	156	20	classification	classification	NOUN
ajst-32394	156	21	,	,	PUNCT
ajst-32394	156	22	offering	offer	VERB
ajst-32394	156	23	rapid	rapid	ADJ
ajst-32394	156	24	,	,	PUNCT
ajst-32394	156	25	cost	cost	NOUN
ajst-32394	156	26	-	-	PUNCT
ajst-32394	156	27	effective	effective	ADJ
ajst-32394	156	28	paradigms	paradigm	NOUN
ajst-32394	156	29	to	to	PART
ajst-32394	156	30	identify	identify	VERB
ajst-32394	156	31	and	and	CCONJ
ajst-32394	156	32	categorize	categorize	VERB
ajst-32394	156	33	hazardous	hazardous	ADJ
ajst-32394	156	34	chemicals	chemical	NOUN
ajst-32394	156	35	from	from	ADP
ajst-32394	156	36	environmental	environmental	ADJ
ajst-32394	156	37	matrices	matrix	NOUN
ajst-32394	156	38	,	,	PUNCT
ajst-32394	156	39	obviating	obviate	VERB
ajst-32394	156	40	the	the	DET
ajst-32394	156	41	exigencies	exigency	NOUN
ajst-32394	156	42	of	of	ADP
ajst-32394	156	43	exhaustive	exhaustive	ADJ
ajst-32394	156	44	empirical	empirical	ADJ
ajst-32394	156	45	assays	assay	NOUN
ajst-32394	156	46	[	[	X
ajst-32394	156	47	58	58	NUM
ajst-32394	156	48	]	]	PUNCT
ajst-32394	156	49	.	.	PUNCT
ajst-32394	157	1	for	for	ADP
ajst-32394	157	2	groundwater	groundwater	NOUN
ajst-32394	157	3	remediation	remediation	NOUN
ajst-32394	157	4	,	,	PUNCT
ajst-32394	157	5	nonnegative	nonnegative	ADJ
ajst-32394	157	6	matrix	matrix	NOUN
ajst-32394	157	7	factorization	factorization	NOUN
ajst-32394	157	8	(	(	PUNCT
ajst-32394	157	9	nmf	nmf	NOUN
ajst-32394	157	10	)	)	PUNCT
ajst-32394	157	11	fused	fuse	VERB
ajst-32394	157	12	with	with	ADP
ajst-32394	157	13	bespoke	bespoke	NOUN
ajst-32394	157	14	semi	semi	ADJ
ajst-32394	157	15	-	-	ADJ
ajst-32394	157	16	supervised	supervised	ADJ
ajst-32394	157	17	clustering	clustering	NOUN
ajst-32394	157	18	—	—	PUNCT
ajst-32394	157	19	the	the	DET
ajst-32394	157	20	nmfk	nmfk	NOUN
ajst-32394	157	21	algorithm	algorithm	NOUN
ajst-32394	157	22	—	—	PUNCT
ajst-32394	157	23	unravels	unravel	VERB
ajst-32394	157	24	contaminant	contaminant	NOUN
ajst-32394	157	25	provenance	provenance	NOUN
ajst-32394	157	26	sans	san	NOUN
ajst-32394	157	27	ancillary	ancillary	ADJ
ajst-32394	157	28	geospatial	geospatial	ADJ
ajst-32394	157	29	priors	prior	NOUN
ajst-32394	157	30	.	.	PUNCT
ajst-32394	158	1	by	by	ADP
ajst-32394	158	2	decomposing	decompose	VERB
ajst-32394	158	3	geochemical	geochemical	ADJ
ajst-32394	158	4	amalgamations	amalgamation	NOUN
ajst-32394	158	5	—	—	PUNCT
ajst-32394	158	6	concentrations	concentration	NOUN
ajst-32394	158	7	,	,	PUNCT
ajst-32394	158	8	isotopic	isotopic	ADJ
ajst-32394	158	9	ratios	ratio	NOUN
ajst-32394	158	10	,	,	PUNCT
ajst-32394	158	11	delta	delta	NOUN
ajst-32394	158	12	notations	notation	NOUN
ajst-32394	158	13	—	—	PUNCT
ajst-32394	158	14	into	into	ADP
ajst-32394	158	15	latent	latent	ADJ
ajst-32394	158	16	factors	factor	NOUN
ajst-32394	158	17	,	,	PUNCT
ajst-32394	158	18	nmfk	nmfk	PROPN
ajst-32394	158	19	infers	infer	NOUN
ajst-32394	158	20	endogenous	endogenous	ADJ
ajst-32394	158	21	source	source	NOUN
ajst-32394	158	22	quanta	quanta	NOUN
ajst-32394	158	23	and	and	CCONJ
ajst-32394	158	24	admixture	admixture	NOUN
ajst-32394	158	25	coefficients	coefficient	NOUN
ajst-32394	158	26	,	,	PUNCT
ajst-32394	158	27	discerning	discern	VERB
ajst-32394	158	28	hitherto	hitherto	NOUN
ajst-32394	158	29	occult	occult	NOUN
ajst-32394	158	30	plumes	plume	NOUN
ajst-32394	158	31	in	in	ADP
ajst-32394	158	32	synthetic	synthetic	ADJ
ajst-32394	158	33	and	and	CCONJ
ajst-32394	158	34	empirical	empirical	ADJ
ajst-32394	158	35	vignettes	vignette	NOUN
ajst-32394	158	36	,	,	PUNCT
ajst-32394	158	37	such	such	ADJ
ajst-32394	158	38	as	as	ADP
ajst-32394	158	39	uranium	uranium	NOUN
ajst-32394	158	40	leachates	leachate	NOUN
ajst-32394	158	41	or	or	CCONJ
ajst-32394	158	42	pesticide	pesticide	NOUN
ajst-32394	158	43	cocktails	cocktail	NOUN
ajst-32394	158	44	.	.	PUNCT
ajst-32394	159	1	validated	validate	VERB
ajst-32394	159	2	on	on	ADP
ajst-32394	159	3	arid	arid	PROPN
ajst-32394	159	4	basin	basin	PROPN
ajst-32394	159	5	telemetry	telemetry	PROPN
ajst-32394	159	6	,	,	PUNCT
ajst-32394	159	7	it	it	PRON
ajst-32394	159	8	attains	attain	VERB
ajst-32394	159	9	95	95	NUM
ajst-32394	159	10	%	%	NOUN
ajst-32394	159	11	source	source	NOUN
ajst-32394	159	12	fidelity	fidelity	NOUN
ajst-32394	159	13	,	,	PUNCT
ajst-32394	159	14	outpacing	outpace	VERB
ajst-32394	159	15	principal	principal	ADJ
ajst-32394	159	16	component	component	NOUN
ajst-32394	159	17	analysis	analysis	NOUN
ajst-32394	159	18	by	by	ADP
ajst-32394	159	19	imputing	impute	VERB
ajst-32394	159	20	sparsity	sparsity	NOUN
ajst-32394	159	21	-	-	PUNCT
ajst-32394	159	22	constrained	constrain	VERB
ajst-32394	159	23	deconvolutions	deconvolution	NOUN
ajst-32394	159	24	.	.	PUNCT
ajst-32394	160	1	such	such	ADJ
ajst-32394	160	2	blind	blind	ADJ
ajst-32394	160	3	separations	separation	NOUN
ajst-32394	160	4	democratize	democratize	VERB
ajst-32394	160	5	forensics	forensic	NOUN
ajst-32394	160	6	,	,	PUNCT
ajst-32394	160	7	empowering	empower	VERB
ajst-32394	160	8	nascent	nascent	ADJ
ajst-32394	160	9	agencies	agency	NOUN
ajst-32394	160	10	to	to	PART
ajst-32394	160	11	triage	triage	VERB
ajst-32394	160	12	interventions	intervention	NOUN
ajst-32394	160	13	amid	amid	ADP
ajst-32394	160	14	fiscal	fiscal	ADJ
ajst-32394	160	15	stringencies	stringency	NOUN
ajst-32394	160	16	.	.	PUNCT
ajst-32394	161	1	in	in	ADP
ajst-32394	161	2	plastic	plastic	ADJ
ajst-32394	161	3	packaging	packaging	NOUN
ajst-32394	161	4	leachates	leachate	NOUN
ajst-32394	161	5	,	,	PUNCT
ajst-32394	161	6	classification	classification	NOUN
ajst-32394	161	7	ml	ml	NOUN
ajst-32394	161	8	—	—	PUNCT
ajst-32394	161	9	random	random	ADJ
ajst-32394	161	10	forest	forest	NOUN
ajst-32394	161	11	,	,	PUNCT
ajst-32394	161	12	svm	svm	PROPN
ajst-32394	161	13	,	,	PUNCT
ajst-32394	161	14	lda	lda	PROPN
ajst-32394	161	15	,	,	PUNCT
ajst-32394	161	16	logistic	logistic	ADJ
ajst-32394	161	17	regression	regression	NOUN
ajst-32394	161	18	—	—	PUNCT
ajst-32394	161	19	interrogates	interrogate	VERB
ajst-32394	161	20	2d	2d	NUM
ajst-32394	161	21	descriptors	descriptor	NOUN
ajst-32394	161	22	post	post	ADV
ajst-32394	161	23	-	-	ADJ
ajst-32394	161	24	resampling	resample	VERB
ajst-32394	161	25	for	for	ADP
ajst-32394	161	26	class	class	NOUN
ajst-32394	161	27	equipoise	equipoise	NOUN
ajst-32394	161	28	,	,	PUNCT
ajst-32394	161	29	prognosticating	prognosticate	VERB
ajst-32394	161	30	neuro-	neuro-	X
ajst-32394	161	31	,	,	PUNCT
ajst-32394	161	32	hepato-	hepato-	X
ajst-32394	161	33	,	,	PUNCT
ajst-32394	161	34	and	and	CCONJ
ajst-32394	161	35	carcinogenicity	carcinogenicity	NOUN
ajst-32394	161	36	at	at	ADP
ajst-32394	161	37	≥0.80	≥0.80	NOUN
ajst-32394	161	38	accuracies	accuracy	NOUN
ajst-32394	161	39	across	across	ADP
ajst-32394	161	40	train	train	NOUN
ajst-32394	161	41	-	-	PUNCT
ajst-32394	161	42	test	test	NOUN
ajst-32394	161	43	bifurcations	bifurcation	NOUN
ajst-32394	161	44	[	[	X
ajst-32394	161	45	59	59	NUM
ajst-32394	161	46	]	]	PUNCT
ajst-32394	161	47	.	.	PUNCT
ajst-32394	162	1	10	10	NUM
ajst-32394	162	2	.	.	PUNCT
ajst-32394	162	3	machine	machine	NOUN
ajst-32394	162	4	learning	learning	NOUN
ajst-32394	162	5	in	in	ADP
ajst-32394	162	6	high	high	ADJ
ajst-32394	162	7	-	-	PUNCT
ajst-32394	162	8	throughput	throughput	NOUN
ajst-32394	162	9	toxicological	toxicological	ADJ
ajst-32394	162	10	screening	screen	VERB
ajst-32394	162	11	machine	machine	NOUN
ajst-32394	162	12	learning	learning	NOUN
ajst-32394	162	13	(	(	PUNCT
ajst-32394	162	14	ml	ml	NOUN
ajst-32394	162	15	)	)	PUNCT
ajst-32394	162	16	is	be	AUX
ajst-32394	162	17	catalyzing	catalyze	VERB
ajst-32394	162	18	a	a	DET
ajst-32394	162	19	renaissance	renaissance	NOUN
ajst-32394	162	20	in	in	ADP
ajst-32394	162	21	high	high	ADJ
ajst-32394	162	22	-	-	PUNCT
ajst-32394	162	23	throughput	throughput	NOUN
ajst-32394	162	24	toxicological	toxicological	ADJ
ajst-32394	162	25	screening	screening	NOUN
ajst-32394	162	26	(	(	PUNCT
ajst-32394	162	27	hts	hts	PROPN
ajst-32394	162	28	)	)	PUNCT
ajst-32394	162	29	,	,	PUNCT
ajst-32394	162	30	empowering	empower	VERB
ajst-32394	162	31	the	the	DET
ajst-32394	162	32	dissection	dissection	NOUN
ajst-32394	162	33	of	of	ADP
ajst-32394	162	34	massive	massive	ADJ
ajst-32394	162	35	assay	assay	NOUN
ajst-32394	162	36	corpora	corpora	PROPN
ajst-32394	162	37	to	to	PART
ajst-32394	162	38	unearth	unearth	VERB
ajst-32394	162	39	bioactive	bioactive	NOUN
ajst-32394	162	40	and	and	CCONJ
ajst-32394	162	41	toxic	toxic	ADJ
ajst-32394	162	42	signatures	signature	NOUN
ajst-32394	162	43	with	with	ADP
ajst-32394	162	44	unprecedented	unprecedented	ADJ
ajst-32394	162	45	celerity	celerity	NOUN
ajst-32394	162	46	and	and	CCONJ
ajst-32394	162	47	fidelity	fidelity	NOUN
ajst-32394	162	48	,	,	PUNCT
ajst-32394	162	49	supplanting	supplant	VERB
ajst-32394	162	50	the	the	DET
ajst-32394	162	51	logistical	logistical	ADJ
ajst-32394	162	52	encumbrances	encumbrance	NOUN
ajst-32394	162	53	of	of	ADP
ajst-32394	162	54	robotic	robotic	ADJ
ajst-32394	162	55	pipelines	pipeline	NOUN
ajst-32394	162	56	[	[	X
ajst-32394	162	57	60	60	NUM
ajst-32394	162	58	]	]	PUNCT
ajst-32394	162	59	.	.	PUNCT
ajst-32394	163	1	209	209	NUM
ajst-32394	163	2	in	in	ADP
ajst-32394	163	3	3d	3d	NUM
ajst-32394	163	4	cell	cell	NOUN
ajst-32394	163	5	cultures	culture	NOUN
ajst-32394	163	6	—	—	PUNCT
ajst-32394	163	7	mimicking	mimic	VERB
ajst-32394	163	8	in	in	ADP
ajst-32394	163	9	vivo	vivo	ADJ
ajst-32394	163	10	architectures	architecture	NOUN
ajst-32394	163	11	with	with	ADP
ajst-32394	163	12	stromal	stromal	ADJ
ajst-32394	163	13	and	and	CCONJ
ajst-32394	163	14	vascular	vascular	ADJ
ajst-32394	163	15	niches	niche	NOUN
ajst-32394	163	16	—	—	PUNCT
ajst-32394	163	17	ml	ml	ADP
ajst-32394	163	18	integrates	integrate	NOUN
ajst-32394	163	19	microfabrication	microfabrication	NOUN
ajst-32394	163	20	,	,	PUNCT
ajst-32394	163	21	automation	automation	NOUN
ajst-32394	163	22	,	,	PUNCT
ajst-32394	163	23	and	and	CCONJ
ajst-32394	163	24	quantitative	quantitative	ADJ
ajst-32394	163	25	hts	ht	NOUN
ajst-32394	163	26	to	to	PART
ajst-32394	163	27	decode	decode	VERB
ajst-32394	163	28	pharmacological	pharmacological	NOUN
ajst-32394	163	29	and	and	CCONJ
ajst-32394	163	30	toxicological	toxicological	ADJ
ajst-32394	163	31	spectra	spectra	NOUN
ajst-32394	163	32	.	.	PUNCT
ajst-32394	164	1	challenges	challenge	NOUN
ajst-32394	164	2	like	like	ADP
ajst-32394	164	3	optical	optical	ADJ
ajst-32394	164	4	heterogeneity	heterogeneity	NOUN
ajst-32394	164	5	yield	yield	NOUN
ajst-32394	164	6	to	to	ADP
ajst-32394	164	7	u	u	NOUN
ajst-32394	164	8	-	-	ADJ
ajst-32394	164	9	net	net	ADJ
ajst-32394	164	10	segmentations	segmentation	NOUN
ajst-32394	164	11	,	,	PUNCT
ajst-32394	164	12	isolating	isolate	VERB
ajst-32394	164	13	necrotic	necrotic	ADJ
ajst-32394	164	14	cores	core	NOUN
ajst-32394	164	15	for	for	ADP
ajst-32394	164	16	dose	dose	NOUN
ajst-32394	164	17	-	-	PUNCT
ajst-32394	164	18	response	response	NOUN
ajst-32394	164	19	parametrization	parametrization	NOUN
ajst-32394	164	20	.	.	PUNCT
ajst-32394	165	1	recent	recent	ADJ
ajst-32394	165	2	2025	2025	NUM
ajst-32394	165	3	paradigms	paradigm	NOUN
ajst-32394	165	4	,	,	PUNCT
ajst-32394	165	5	per	per	ADP
ajst-32394	165	6	pang	pang	NOUN
ajst-32394	165	7	et	et	PROPN
ajst-32394	165	8	al	al	PROPN
ajst-32394	165	9	.	.	PROPN
ajst-32394	165	10	's	's	PART
ajst-32394	165	11	neutox	neutox	NOUN
ajst-32394	165	12	2.0	2.0	NUM
ajst-32394	165	13	,	,	PUNCT
ajst-32394	165	14	fuse	fuse	NOUN
ajst-32394	165	15	multimodal	multimodal	NOUN
ajst-32394	165	16	features	feature	NOUN
ajst-32394	165	17	—	—	PUNCT
ajst-32394	165	18	structural	structural	ADJ
ajst-32394	165	19	embeddings	embedding	NOUN
ajst-32394	165	20	with	with	ADP
ajst-32394	165	21	phenotypic	phenotypic	ADJ
ajst-32394	165	22	readouts	readout	NOUN
ajst-32394	165	23	—	—	PUNCT
ajst-32394	165	24	in	in	ADP
ajst-32394	165	25	hybrid	hybrid	ADJ
ajst-32394	165	26	dl	dl	PROPN
ajst-32394	165	27	architectures	architecture	NOUN
ajst-32394	165	28	,	,	PUNCT
ajst-32394	165	29	prognosticating	prognosticate	VERB
ajst-32394	165	30	neurotoxicity	neurotoxicity	NOUN
ajst-32394	165	31	facets	facet	NOUN
ajst-32394	165	32	at	at	ADP
ajst-32394	165	33	0.87	0.87	NUM
ajst-32394	165	34	auc	auc	NOUN
ajst-32394	165	35	across	across	ADP
ajst-32394	165	36	4,746	4,746	NUM
ajst-32394	165	37	toxcast	toxcast	NOUN
ajst-32394	165	38	endpoints	endpoint	NOUN
ajst-32394	165	39	,	,	PUNCT
ajst-32394	165	40	enabling	enable	VERB
ajst-32394	165	41	virtual	virtual	ADJ
ajst-32394	165	42	triages	triage	NOUN
ajst-32394	165	43	that	that	PRON
ajst-32394	165	44	eclipse	eclipse	VERB
ajst-32394	165	45	2d	2d	NOUN
ajst-32394	165	46	monocultures	monoculture	NOUN
ajst-32394	165	47	in	in	ADP
ajst-32394	165	48	physiological	physiological	ADJ
ajst-32394	165	49	relevance	relevance	NOUN
ajst-32394	165	50	[	[	X
ajst-32394	165	51	61	61	NUM
ajst-32394	165	52	]	]	PUNCT
ajst-32394	165	53	.	.	PUNCT
ajst-32394	166	1	this	this	DET
ajst-32394	166	2	scalability	scalability	NOUN
ajst-32394	166	3	curtails	curtail	VERB
ajst-32394	166	4	attrition	attrition	NOUN
ajst-32394	166	5	,	,	PUNCT
ajst-32394	166	6	nominating	nominating	NOUN
ajst-32394	166	7	safer	safe	ADJ
ajst-32394	166	8	scaffolds	scaffold	NOUN
ajst-32394	166	9	for	for	ADP
ajst-32394	166	10	oncology	oncology	NOUN
ajst-32394	166	11	pipelines	pipeline	NOUN
ajst-32394	166	12	.	.	PUNCT
ajst-32394	167	1	gps	gps	PROPN
ajst-32394	167	2	’	'	PUNCT
ajst-32394	167	3	uncertainty	uncertainty	NOUN
ajst-32394	167	4	quantification	quantification	NOUN
ajst-32394	167	5	flags	flag	NOUN
ajst-32394	167	6	outliers	outlier	NOUN
ajst-32394	167	7	for	for	ADP
ajst-32394	167	8	orthogonal	orthogonal	ADJ
ajst-32394	167	9	assays	assay	NOUN
ajst-32394	167	10	,	,	PUNCT
ajst-32394	167	11	mitigating	mitigate	VERB
ajst-32394	167	12	autofluorescence	autofluorescence	NOUN
ajst-32394	167	13	pitfalls	pitfall	NOUN
ajst-32394	167	14	.	.	PUNCT
ajst-32394	168	1	as	as	ADP
ajst-32394	168	2	2025	2025	NUM
ajst-32394	168	3	reviews	review	NOUN
ajst-32394	168	4	in	in	ADP
ajst-32394	168	5	acs	acs	PROPN
ajst-32394	168	6	central	central	ADJ
ajst-32394	168	7	science	science	NOUN
ajst-32394	168	8	affirm	affirm	NOUN
ajst-32394	168	9	,	,	PUNCT
ajst-32394	168	10	minimum	minimum	ADJ
ajst-32394	168	11	variance	variance	NOUN
ajst-32394	168	12	sampling	sample	VERB
ajst-32394	168	13	(	(	PUNCT
ajst-32394	168	14	mvs	mvs	NOUN
ajst-32394	168	15	-	-	PUNCT
ajst-32394	168	16	a)—a	a)—a	NOUN
ajst-32394	168	17	dl	dl	NOUN
ajst-32394	168	18	-	-	PUNCT
ajst-32394	168	19	driven	drive	VERB
ajst-32394	168	20	hit	hit	NOUN
ajst-32394	168	21	prioritizer	prioritizer	NOUN
ajst-32394	168	22	—	—	PUNCT
ajst-32394	168	23	overlaps	overlap	VERB
ajst-32394	168	24	66	66	NUM
ajst-32394	168	25	%	%	NOUN
ajst-32394	168	26	with	with	ADP
ajst-32394	168	27	artifact	artifact	ADJ
ajst-32394	168	28	predictors	predictor	NOUN
ajst-32394	168	29	,	,	PUNCT
ajst-32394	168	30	distinguishing	distinguish	VERB
ajst-32394	168	31	true	true	ADJ
ajst-32394	168	32	bioactives	bioactive	NOUN
ajst-32394	168	33	from	from	ADP
ajst-32394	168	34	false	false	ADJ
ajst-32394	168	35	positives	positive	NOUN
ajst-32394	168	36	in	in	ADP
ajst-32394	168	37	noisy	noisy	ADJ
ajst-32394	168	38	hts	ht	NOUN
ajst-32394	168	39	,	,	PUNCT
ajst-32394	168	40	thereby	thereby	ADV
ajst-32394	168	41	refining	refine	VERB
ajst-32394	168	42	phytochemical	phytochemical	ADJ
ajst-32394	168	43	leads	lead	NOUN
ajst-32394	168	44	for	for	ADP
ajst-32394	168	45	gut	gut	NOUN
ajst-32394	168	46	microbiome	microbiome	ADJ
ajst-32394	168	47	therapeutics	therapeutic	NOUN
ajst-32394	168	48	[	[	X
ajst-32394	168	49	62	62	NUM
ajst-32394	168	50	]	]	PUNCT
ajst-32394	168	51	.	.	PUNCT
ajst-32394	169	1	graph	graph	NOUN
ajst-32394	169	2	ml	ml	NOUN
ajst-32394	169	3	further	far	ADV
ajst-32394	169	4	optimizes	optimize	VERB
ajst-32394	169	5	phenotypic	phenotypic	ADJ
ajst-32394	169	6	screens	screen	NOUN
ajst-32394	169	7	for	for	ADP
ajst-32394	169	8	repurposing	repurpose	VERB
ajst-32394	169	9	,	,	PUNCT
ajst-32394	169	10	as	as	ADP
ajst-32394	169	11	in	in	ADP
ajst-32394	169	12	schizophrenia	schizophrenia	NOUN
ajst-32394	169	13	models	model	NOUN
ajst-32394	169	14	where	where	SCONJ
ajst-32394	169	15	deep	deep	ADJ
ajst-32394	169	16	graph	graph	NOUN
ajst-32394	169	17	networks	network	NOUN
ajst-32394	169	18	(	(	PUNCT
ajst-32394	169	19	dgns	dgns	PROPN
ajst-32394	169	20	)	)	PUNCT
ajst-32394	169	21	forecast	forecast	NOUN
ajst-32394	169	22	glial	glial	ADJ
ajst-32394	169	23	phagocytosis	phagocytosis	NOUN
ajst-32394	169	24	scores	score	NOUN
ajst-32394	169	25	from	from	ADP
ajst-32394	169	26	compound	compound	NOUN
ajst-32394	169	27	-	-	PUNCT
ajst-32394	169	28	concentration	concentration	NOUN
ajst-32394	169	29	inputs	input	NOUN
ajst-32394	169	30	across	across	ADP
ajst-32394	169	31	2,218	2,218	NUM
ajst-32394	169	32	candidates	candidate	NOUN
ajst-32394	169	33	at	at	ADP
ajst-32394	169	34	five	five	NUM
ajst-32394	169	35	doses	dose	NOUN
ajst-32394	169	36	.	.	PUNCT
ajst-32394	170	1	prioritizing	prioritize	VERB
ajst-32394	170	2	sweetlead	sweetlead	NOUN
ajst-32394	170	3	libraries	library	NOUN
ajst-32394	170	4	,	,	PUNCT
ajst-32394	170	5	dgns	dgn	VERB
ajst-32394	170	6	evince	evince	NOUN
ajst-32394	170	7	0.82	0.82	NUM
ajst-32394	170	8	precision	precision	NOUN
ajst-32394	170	9	in	in	ADP
ajst-32394	170	10	nominating	nominating	NOUN
ajst-32394	170	11	synaptophagic	synaptophagic	ADJ
ajst-32394	170	12	modulators	modulator	NOUN
ajst-32394	170	13	,	,	PUNCT
ajst-32394	170	14	validated	validate	VERB
ajst-32394	170	15	in	in	ADP
ajst-32394	170	16	ipsc	ipsc	NOUN
ajst-32394	170	17	-	-	PUNCT
ajst-32394	170	18	derived	derive	VERB
ajst-32394	170	19	astrocytes	astrocyte	NOUN
ajst-32394	170	20	[	[	PUNCT
ajst-32394	170	21	63	63	NUM
ajst-32394	170	22	]	]	PUNCT
ajst-32394	170	23	.	.	PUNCT
ajst-32394	171	1	extending	extend	VERB
ajst-32394	171	2	to	to	ADP
ajst-32394	171	3	tox	tox	NOUN
ajst-32394	171	4	screens	screen	NOUN
ajst-32394	171	5	,	,	PUNCT
ajst-32394	171	6	these	these	DET
ajst-32394	171	7	networks	network	NOUN
ajst-32394	171	8	encode	encode	VERB
ajst-32394	171	9	assay	assay	NOUN
ajst-32394	171	10	graphs	graph	NOUN
ajst-32394	171	11	—	—	PUNCT
ajst-32394	171	12	nodes	node	NOUN
ajst-32394	171	13	as	as	ADP
ajst-32394	171	14	perturbations	perturbation	NOUN
ajst-32394	171	15	,	,	PUNCT
ajst-32394	171	16	edges	edge	NOUN
ajst-32394	171	17	as	as	ADP
ajst-32394	171	18	causal	causal	ADJ
ajst-32394	171	19	arcs	arc	NOUN
ajst-32394	171	20	—	—	PUNCT
ajst-32394	171	21	to	to	PART
ajst-32394	171	22	impute	impute	VERB
ajst-32394	171	23	off	off	ADP
ajst-32394	171	24	-	-	PUNCT
ajst-32394	171	25	targets	target	NOUN
ajst-32394	171	26	,	,	PUNCT
ajst-32394	171	27	as	as	ADP
ajst-32394	171	28	in	in	ADP
ajst-32394	171	29	2025	2025	NUM
ajst-32394	171	30	's	's	PART
ajst-32394	171	31	atomnet	atomnet	NOUN
ajst-32394	171	32	prospective	prospective	ADJ
ajst-32394	171	33	on	on	ADP
ajst-32394	171	34	318	318	NUM
ajst-32394	171	35	targets	target	NOUN
ajst-32394	171	36	,	,	PUNCT
ajst-32394	171	37	rivaling	rival	VERB
ajst-32394	171	38	physical	physical	ADJ
ajst-32394	171	39	hts	ht	NOUN
ajst-32394	171	40	hit	hit	VERB
ajst-32394	171	41	rates	rate	NOUN
ajst-32394	171	42	sans	san	NOUN
ajst-32394	171	43	physical	physical	ADJ
ajst-32394	171	44	synthesis	synthesis	NOUN
ajst-32394	171	45	[	[	X
ajst-32394	171	46	64	64	NUM
ajst-32394	171	47	]	]	PUNCT
ajst-32394	171	48	.	.	PUNCT
ajst-32394	172	1	11	11	NUM
ajst-32394	172	2	.	.	PUNCT
ajst-32394	172	3	emerging	emerge	VERB
ajst-32394	172	4	trends	trend	NOUN
ajst-32394	172	5	in	in	ADP
ajst-32394	172	6	machine	machine	NOUN
ajst-32394	172	7	learning	learn	VERB
ajst-32394	172	8	for	for	ADP
ajst-32394	172	9	toxicology	toxicology	NOUN
ajst-32394	172	10	the	the	DET
ajst-32394	172	11	field	field	NOUN
ajst-32394	172	12	of	of	ADP
ajst-32394	172	13	toxicology	toxicology	NOUN
ajst-32394	172	14	is	be	AUX
ajst-32394	172	15	witnessing	witness	VERB
ajst-32394	172	16	transformative	transformative	ADJ
ajst-32394	172	17	emerging	emerge	VERB
ajst-32394	172	18	trends	trend	NOUN
ajst-32394	172	19	in	in	ADP
ajst-32394	172	20	machine	machine	NOUN
ajst-32394	172	21	learning	learning	NOUN
ajst-32394	172	22	,	,	PUNCT
ajst-32394	172	23	propelled	propel	VERB
ajst-32394	172	24	by	by	ADP
ajst-32394	172	25	the	the	DET
ajst-32394	172	26	convergence	convergence	NOUN
ajst-32394	172	27	of	of	ADP
ajst-32394	172	28	big	big	ADJ
ajst-32394	172	29	data	datum	NOUN
ajst-32394	172	30	,	,	PUNCT
ajst-32394	172	31	deep	deep	ADJ
ajst-32394	172	32	learning	learning	NOUN
ajst-32394	172	33	architectures	architecture	NOUN
ajst-32394	172	34	,	,	PUNCT
ajst-32394	172	35	and	and	CCONJ
ajst-32394	172	36	multimodal	multimodal	NOUN
ajst-32394	172	37	integrations	integration	NOUN
ajst-32394	172	38	that	that	PRON
ajst-32394	172	39	promise	promise	VERB
ajst-32394	172	40	to	to	PART
ajst-32394	172	41	redefine	redefine	VERB
ajst-32394	172	42	toxicity	toxicity	NOUN
ajst-32394	172	43	assessment	assessment	NOUN
ajst-32394	172	44	paradigms	paradigm	VERB
ajst-32394	172	45	.	.	PUNCT
ajst-32394	173	1	as	as	SCONJ
ajst-32394	173	2	computational	computational	ADJ
ajst-32394	173	3	resources	resource	NOUN
ajst-32394	173	4	burgeon	burgeon	NOUN
ajst-32394	173	5	and	and	CCONJ
ajst-32394	173	6	omics	omic	NOUN
ajst-32394	173	7	datasets	dataset	NOUN
ajst-32394	173	8	proliferate	proliferate	VERB
ajst-32394	173	9	,	,	PUNCT
ajst-32394	173	10	as	as	ADP
ajst-32394	173	11	in	in	ADP
ajst-32394	173	12	deepauto	deepauto	NOUN
ajst-32394	173	13	qsar	qsar	NOUN
ajst-32394	173	14	,	,	PUNCT
ajst-32394	173	15	automate	automate	ADJ
ajst-32394	173	16	pipeline	pipeline	NOUN
ajst-32394	173	17	orchestration	orchestration	NOUN
ajst-32394	173	18	,	,	PUNCT
ajst-32394	173	19	blending	blend	VERB
ajst-32394	173	20	boosted	boost	VERB
ajst-32394	173	21	trees	tree	NOUN
ajst-32394	173	22	with	with	ADP
ajst-32394	173	23	gnns	gnn	NOUN
ajst-32394	173	24	for	for	ADP
ajst-32394	173	25	solubility	solubility	NOUN
ajst-32394	173	26	and	and	CCONJ
ajst-32394	173	27	herg	herg	PROPN
ajst-32394	173	28	predictions	prediction	NOUN
ajst-32394	173	29	,	,	PUNCT
ajst-32394	173	30	attaining	attain	VERB
ajst-32394	173	31	0.88	0.88	NUM
ajst-32394	173	32	aurocs	auroc	NOUN
ajst-32394	173	33	while	while	SCONJ
ajst-32394	173	34	furnishing	furnish	VERB
ajst-32394	173	35	shap	shap	PROPN
ajst-32394	173	36	attributions	attribution	NOUN
ajst-32394	173	37	for	for	ADP
ajst-32394	173	38	regulatory	regulatory	ADJ
ajst-32394	173	39	audits	audits	NOUN
ajst-32394	173	40	[	[	X
ajst-32394	173	41	65	65	NUM
ajst-32394	173	42	,	,	PUNCT
ajst-32394	173	43	66	66	NUM
ajst-32394	173	44	]	]	PUNCT
ajst-32394	173	45	.	.	PUNCT
ajst-32394	174	1	this	this	DET
ajst-32394	174	2	descriptor	descriptor	NOUN
ajst-32394	174	3	-	-	PUNCT
ajst-32394	174	4	free	free	ADJ
ajst-32394	174	5	ethos	ethos	NOUN
ajst-32394	174	6	democratizes	democratize	VERB
ajst-32394	174	7	qsar	qsar	NOUN
ajst-32394	174	8	,	,	PUNCT
ajst-32394	174	9	extending	extend	VERB
ajst-32394	174	10	to	to	ADP
ajst-32394	174	11	nanomaterials	nanomaterial	NOUN
ajst-32394	174	12	where	where	SCONJ
ajst-32394	174	13	gnns	gnns	ADJ
ajst-32394	174	14	encode	encode	ADJ
ajst-32394	174	15	agglomeration	agglomeration	NOUN
ajst-32394	174	16	dynamics	dynamic	NOUN
ajst-32394	174	17	,	,	PUNCT
ajst-32394	174	18	unmasking	unmask	VERB
ajst-32394	174	19	genotoxic	genotoxic	ADJ
ajst-32394	174	20	coronas	corona	NOUN
ajst-32394	174	21	with	with	ADP
ajst-32394	174	22	85	85	NUM
ajst-32394	174	23	%	%	NOUN
ajst-32394	174	24	precisions	precision	NOUN
ajst-32394	174	25	[	[	X
ajst-32394	174	26	67	67	NUM
ajst-32394	174	27	]	]	PUNCT
ajst-32394	174	28	.	.	PUNCT
ajst-32394	175	1	another	another	DET
ajst-32394	175	2	burgeoning	burgeon	VERB
ajst-32394	175	3	frontier	frontier	NOUN
ajst-32394	175	4	is	be	AUX
ajst-32394	175	5	ml	ml	NOUN
ajst-32394	175	6	's	's	PART
ajst-32394	175	7	infusion	infusion	NOUN
ajst-32394	175	8	into	into	ADP
ajst-32394	175	9	radiogenomics	radiogenomic	NOUN
ajst-32394	175	10	for	for	ADP
ajst-32394	175	11	oncology	oncology	NOUN
ajst-32394	175	12	,	,	PUNCT
ajst-32394	175	13	fusing	fuse	VERB
ajst-32394	175	14	radiological	radiological	ADJ
ajst-32394	175	15	phenotypes	phenotype	NOUN
ajst-32394	175	16	with	with	ADP
ajst-32394	175	17	genomic	genomic	ADJ
ajst-32394	175	18	signatures	signature	NOUN
ajst-32394	175	19	to	to	PART
ajst-32394	175	20	illuminate	illuminate	VERB
ajst-32394	175	21	tumor	tumor	NOUN
ajst-32394	175	22	microenvironments	microenvironment	NOUN
ajst-32394	175	23	non	non	ADJ
ajst-32394	175	24	-	-	ADJ
ajst-32394	175	25	invasively	invasively	ADV
ajst-32394	175	26	.	.	PUNCT
ajst-32394	176	1	deep	deep	ADJ
ajst-32394	176	2	architectures	architecture	NOUN
ajst-32394	176	3	—	—	PUNCT
ajst-32394	176	4	cnns	cnn	NOUN
ajst-32394	176	5	and	and	CCONJ
ajst-32394	176	6	transformers	transformer	NOUN
ajst-32394	176	7	—	—	PUNCT
ajst-32394	176	8	interrogate	interrogate	ADJ
ajst-32394	176	9	mri	mri	NOUN
ajst-32394	176	10	/	/	SYM
ajst-32394	176	11	ct	ct	NUM
ajst-32394	176	12	voxels	voxel	NOUN
ajst-32394	176	13	alongside	alongside	ADP
ajst-32394	176	14	ngs	ng	NOUN
ajst-32394	176	15	variants	variant	NOUN
ajst-32394	176	16	,	,	PUNCT
ajst-32394	176	17	prognosticating	prognosticate	VERB
ajst-32394	176	18	mutations	mutation	NOUN
ajst-32394	176	19	like	like	ADP
ajst-32394	176	20	idh1	idh1	NOUN
ajst-32394	176	21	in	in	ADP
ajst-32394	176	22	gliomas	glioma	NOUN
ajst-32394	176	23	with	with	ADP
ajst-32394	176	24	0.87	0.87	NUM
ajst-32394	176	25	aucs	aucs	NOUN
ajst-32394	176	26	,	,	PUNCT
ajst-32394	176	27	obviating	obviate	VERB
ajst-32394	176	28	biopsies	biopsy	NOUN
ajst-32394	176	29	[	[	X
ajst-32394	176	30	68	68	NUM
ajst-32394	176	31	]	]	PUNCT
ajst-32394	176	32	.	.	PUNCT
ajst-32394	177	1	in	in	ADP
ajst-32394	177	2	aptamer	aptamer	NOUN
ajst-32394	177	3	-	-	PUNCT
ajst-32394	177	4	target	target	NOUN
ajst-32394	177	5	binding	bind	VERB
ajst-32394	177	6	prediction	prediction	NOUN
ajst-32394	177	7	,	,	PUNCT
ajst-32394	177	8	ml	ml	ADV
ajst-32394	177	9	and	and	CCONJ
ajst-32394	177	10	deep	deep	ADJ
ajst-32394	177	11	learning	learning	NOUN
ajst-32394	177	12	are	be	AUX
ajst-32394	177	13	gaining	gain	VERB
ajst-32394	177	14	traction	traction	NOUN
ajst-32394	177	15	to	to	PART
ajst-32394	177	16	supplant	supplant	VERB
ajst-32394	177	17	laborious	laborious	ADJ
ajst-32394	177	18	selex	selex	NOUN
ajst-32394	177	19	,	,	PUNCT
ajst-32394	177	20	forecasting	forecast	VERB
ajst-32394	177	21	affinities	affinity	NOUN
ajst-32394	177	22	from	from	ADP
ajst-32394	177	23	sequence	sequence	NOUN
ajst-32394	177	24	-	-	PUNCT
ajst-32394	177	25	structure	structure	NOUN
ajst-32394	177	26	embeddings	embedding	NOUN
ajst-32394	177	27	.	.	PUNCT
ajst-32394	178	1	hybrid	hybrid	ADJ
ajst-32394	178	2	cnn	cnn	PROPN
ajst-32394	178	3	-	-	PUNCT
ajst-32394	178	4	bilstm	bilstm	NOUN
ajst-32394	178	5	models	model	NOUN
ajst-32394	178	6	like	like	ADP
ajst-32394	178	7	deepaptamer	deepaptamer	PROPN
ajst-32394	178	8	ingest	ingest	VERB
ajst-32394	178	9	k	k	ADJ
ajst-32394	178	10	-	-	PUNCT
ajst-32394	178	11	mers	mer	NOUN
ajst-32394	178	12	and	and	CCONJ
ajst-32394	178	13	secondary	secondary	ADJ
ajst-32394	178	14	motifs	motif	NOUN
ajst-32394	178	15	,	,	PUNCT
ajst-32394	178	16	yielding	yield	VERB
ajst-32394	178	17	0.92	0.92	NUM
ajst-32394	178	18	f1	f1	NOUN
ajst-32394	178	19	-	-	PUNCT
ajst-32394	178	20	scores	score	NOUN
ajst-32394	178	21	for	for	ADP
ajst-32394	178	22	highaffinity	highaffinity	NOUN
ajst-32394	178	23	binders	binder	NOUN
ajst-32394	178	24	,	,	PUNCT
ajst-32394	178	25	truncating	truncate	VERB
ajst-32394	178	26	rounds	round	NOUN
ajst-32394	178	27	from	from	ADP
ajst-32394	178	28	20	20	NUM
ajst-32394	178	29	to	to	PART
ajst-32394	178	30	5	5	NUM
ajst-32394	178	31	[	[	NOUN
ajst-32394	178	32	69	69	NUM
ajst-32394	178	33	]	]	SYM
ajst-32394	178	34	.	.	PUNCT
ajst-32394	179	1	2025	2025	NUM
ajst-32394	179	2	innovations	innovation	NOUN
ajst-32394	179	3	,	,	PUNCT
ajst-32394	179	4	as	as	ADP
ajst-32394	179	5	in	in	ADP
ajst-32394	179	6	aptadiff	aptadiff	NOUN
ajst-32394	179	7	's	's	PART
ajst-32394	179	8	diffusion	diffusion	NOUN
ajst-32394	179	9	models	model	NOUN
ajst-32394	179	10	,	,	PUNCT
ajst-32394	179	11	generate	generate	VERB
ajst-32394	179	12	de	de	ADP
ajst-32394	179	13	novo	novo	NOUN
ajst-32394	179	14	aptamers	aptamer	NOUN
ajst-32394	179	15	via	via	ADP
ajst-32394	179	16	latent	latent	ADJ
ajst-32394	179	17	space	space	NOUN
ajst-32394	179	18	sampling	sampling	NOUN
ajst-32394	179	19	,	,	PUNCT
ajst-32394	179	20	validating	validate	VERB
ajst-32394	179	21	thrombin	thrombin	NOUN
ajst-32394	179	22	inhibitors	inhibitor	NOUN
ajst-32394	179	23	at	at	ADP
ajst-32394	179	24	1.5	1.5	NUM
ajst-32394	179	25	nm	nm	NOUN
ajst-32394	179	26	kds—11	kds—11	NOUN
ajst-32394	179	27	-	-	ADJ
ajst-32394	179	28	fold	fold	ADJ
ajst-32394	179	29	above	above	ADP
ajst-32394	179	30	random	random	ADJ
ajst-32394	180	1	[	[	X
ajst-32394	180	2	70	70	NUM
ajst-32394	180	3	]	]	PUNCT
ajst-32394	180	4	.	.	PUNCT
ajst-32394	181	1	transfer	transfer	NOUN
ajst-32394	181	2	learning	learn	VERB
ajst-32394	181	3	from	from	ADP
ajst-32394	181	4	esmfold	esmfold	ADJ
ajst-32394	181	5	embeddings	embedding	NOUN
ajst-32394	181	6	further	far	ADV
ajst-32394	181	7	bolsters	bolster	VERB
ajst-32394	181	8	this	this	PRON
ajst-32394	181	9	,	,	PUNCT
ajst-32394	181	10	predicting	predict	VERB
ajst-32394	181	11	rna	rna	NOUN
ajst-32394	181	12	-	-	PUNCT
ajst-32394	181	13	protein	protein	NOUN
ajst-32394	181	14	hubs	hub	NOUN
ajst-32394	181	15	in	in	ADP
ajst-32394	181	16	viral	viral	ADJ
ajst-32394	181	17	toxicants	toxicant	NOUN
ajst-32394	181	18	with	with	ADP
ajst-32394	181	19	89	89	NUM
ajst-32394	181	20	%	%	NOUN
ajst-32394	181	21	accuracies	accuracy	NOUN
ajst-32394	181	22	[	[	X
ajst-32394	181	23	71	71	NUM
ajst-32394	181	24	]	]	SYM
ajst-32394	181	25	.	.	PUNCT
ajst-32394	182	1	12	12	NUM
ajst-32394	182	2	.	.	PUNCT
ajst-32394	183	1	disscussion	disscussion	NOUN
ajst-32394	183	2	machine	machine	NOUN
ajst-32394	183	3	learning	learning	NOUN
ajst-32394	183	4	(	(	PUNCT
ajst-32394	183	5	ml	ml	NOUN
ajst-32394	183	6	)	)	PUNCT
ajst-32394	183	7	holds	hold	VERB
ajst-32394	183	8	immense	immense	ADJ
ajst-32394	183	9	potential	potential	NOUN
ajst-32394	183	10	in	in	ADP
ajst-32394	183	11	predictive	predictive	ADJ
ajst-32394	183	12	toxicology	toxicology	NOUN
ajst-32394	183	13	,	,	PUNCT
ajst-32394	183	14	offering	offer	VERB
ajst-32394	183	15	scalable	scalable	ADJ
ajst-32394	183	16	,	,	PUNCT
ajst-32394	183	17	ethical	ethical	ADJ
ajst-32394	183	18	alternatives	alternative	NOUN
ajst-32394	183	19	to	to	ADP
ajst-32394	183	20	traditional	traditional	ADJ
ajst-32394	183	21	animal	animal	NOUN
ajst-32394	183	22	testing	testing	NOUN
ajst-32394	183	23	by	by	ADP
ajst-32394	183	24	forecasting	forecast	VERB
ajst-32394	183	25	chemical	chemical	ADJ
ajst-32394	183	26	toxicities	toxicity	NOUN
ajst-32394	183	27	with	with	ADP
ajst-32394	183	28	high	high	ADJ
ajst-32394	183	29	fidelity	fidelity	NOUN
ajst-32394	183	30	,	,	PUNCT
ajst-32394	183	31	thereby	thereby	ADV
ajst-32394	183	32	curbing	curb	VERB
ajst-32394	183	33	the	the	DET
ajst-32394	183	34	30	30	NUM
ajst-32394	183	35	%	%	NOUN
ajst-32394	183	36	attrition	attrition	NOUN
ajst-32394	183	37	rate	rate	NOUN
ajst-32394	183	38	in	in	ADP
ajst-32394	183	39	drug	drug	NOUN
ajst-32394	183	40	pipelines	pipeline	NOUN
ajst-32394	183	41	due	due	ADJ
ajst-32394	183	42	to	to	ADP
ajst-32394	183	43	unforeseen	unforeseen	ADJ
ajst-32394	183	44	adverse	adverse	ADJ
ajst-32394	183	45	effects	effect	NOUN
ajst-32394	183	46	[	[	X
ajst-32394	183	47	72	72	NUM
ajst-32394	183	48	]	]	PUNCT
ajst-32394	183	49	.	.	PUNCT
ajst-32394	184	1	this	this	DET
ajst-32394	184	2	potential	potential	NOUN
ajst-32394	184	3	,	,	PUNCT
ajst-32394	184	4	per	per	ADP
ajst-32394	184	5	recent	recent	ADJ
ajst-32394	184	6	syntheses	synthesis	NOUN
ajst-32394	184	7	,	,	PUNCT
ajst-32394	184	8	manifests	manifest	NOUN
ajst-32394	184	9	in	in	ADP
ajst-32394	184	10	reduced	reduce	VERB
ajst-32394	184	11	timelines	timeline	NOUN
ajst-32394	184	12	and	and	CCONJ
ajst-32394	184	13	costs	cost	NOUN
ajst-32394	184	14	,	,	PUNCT
ajst-32394	184	15	with	with	ADP
ajst-32394	184	16	interpretable	interpretable	ADJ
ajst-32394	184	17	models	model	NOUN
ajst-32394	184	18	nominating	nominate	VERB
ajst-32394	184	19	safe	safe	ADJ
ajst-32394	184	20	candidates	candidate	NOUN
ajst-32394	184	21	while	while	SCONJ
ajst-32394	184	22	elucidating	elucidate	VERB
ajst-32394	184	23	mechanisms	mechanism	NOUN
ajst-32394	184	24	sans	san	NOUN
ajst-32394	184	25	empirical	empirical	ADJ
ajst-32394	184	26	drudgery	drudgery	NOUN
ajst-32394	184	27	[	[	X
ajst-32394	184	28	73	73	NUM
ajst-32394	184	29	]	]	PUNCT
ajst-32394	184	30	.	.	PUNCT
ajst-32394	185	1	210	210	NUM
ajst-32394	185	2	future	future	ADJ
ajst-32394	185	3	directions	direction	NOUN
ajst-32394	185	4	in	in	ADP
ajst-32394	185	5	machine	machine	NOUN
ajst-32394	185	6	learning	learn	VERB
ajst-32394	185	7	research	research	NOUN
ajst-32394	185	8	for	for	ADP
ajst-32394	185	9	toxicology	toxicology	NOUN
ajst-32394	185	10	emphasize	emphasize	VERB
ajst-32394	185	11	enhancing	enhance	VERB
ajst-32394	185	12	model	model	NOUN
ajst-32394	185	13	interpretability	interpretability	NOUN
ajst-32394	185	14	,	,	PUNCT
ajst-32394	185	15	integrating	integrate	VERB
ajst-32394	185	16	diverse	diverse	ADJ
ajst-32394	185	17	data	datum	NOUN
ajst-32394	185	18	sources	source	NOUN
ajst-32394	185	19	,	,	PUNCT
ajst-32394	185	20	and	and	CCONJ
ajst-32394	185	21	addressing	address	VERB
ajst-32394	185	22	complex	complex	ADJ
ajst-32394	185	23	biological	biological	ADJ
ajst-32394	185	24	interactions	interaction	NOUN
ajst-32394	185	25	to	to	PART
ajst-32394	185	26	advance	advance	VERB
ajst-32394	185	27	predictive	predictive	ADJ
ajst-32394	185	28	accuracy	accuracy	NOUN
ajst-32394	185	29	and	and	CCONJ
ajst-32394	185	30	regulatory	regulatory	ADJ
ajst-32394	185	31	acceptance	acceptance	NOUN
ajst-32394	185	32	[	[	X
ajst-32394	185	33	74	74	NUM
ajst-32394	185	34	]	]	PUNCT
ajst-32394	185	35	.	.	PUNCT
ajst-32394	186	1	as	as	SCONJ
ajst-32394	186	2	highlighted	highlight	VERB
ajst-32394	186	3	in	in	ADP
ajst-32394	186	4	recent	recent	ADJ
ajst-32394	186	5	2025	2025	NUM
ajst-32394	186	6	reviews	review	NOUN
ajst-32394	186	7	,	,	PUNCT
ajst-32394	186	8	the	the	DET
ajst-32394	186	9	field	field	NOUN
ajst-32394	186	10	must	must	AUX
ajst-32394	186	11	prioritize	prioritize	VERB
ajst-32394	186	12	explainable	explainable	ADJ
ajst-32394	186	13	ai	ai	NOUN
ajst-32394	186	14	(	(	PUNCT
ajst-32394	186	15	xai	xai	PROPN
ajst-32394	186	16	)	)	PUNCT
ajst-32394	186	17	to	to	PART
ajst-32394	186	18	demystify	demystify	VERB
ajst-32394	186	19	predictions	prediction	NOUN
ajst-32394	186	20	,	,	PUNCT
ajst-32394	186	21	ensuring	ensure	VERB
ajst-32394	186	22	alignment	alignment	NOUN
ajst-32394	186	23	with	with	ADP
ajst-32394	186	24	adverse	adverse	ADJ
ajst-32394	186	25	outcome	outcome	NOUN
ajst-32394	186	26	pathway	pathway	NOUN
ajst-32394	186	27	(	(	PUNCT
ajst-32394	186	28	aop	aop	PROPN
ajst-32394	186	29	)	)	PUNCT
ajst-32394	186	30	frameworks	framework	NOUN
ajst-32394	186	31	and	and	CCONJ
ajst-32394	186	32	ethical	ethical	ADJ
ajst-32394	186	33	standards	standard	NOUN
ajst-32394	186	34	while	while	SCONJ
ajst-32394	186	35	tackling	tackle	VERB
ajst-32394	186	36	data	datum	NOUN
ajst-32394	186	37	scarcity	scarcity	NOUN
ajst-32394	186	38	and	and	CCONJ
ajst-32394	186	39	bias	bias	NOUN
ajst-32394	186	40	.	.	PUNCT
ajst-32394	187	1	improving	improve	VERB
ajst-32394	187	2	interpretability	interpretability	NOUN
ajst-32394	187	3	stands	stand	VERB
ajst-32394	187	4	as	as	ADP
ajst-32394	187	5	a	a	DET
ajst-32394	187	6	cornerstone	cornerstone	NOUN
ajst-32394	187	7	,	,	PUNCT
ajst-32394	187	8	with	with	ADP
ajst-32394	187	9	techniques	technique	NOUN
ajst-32394	187	10	like	like	ADP
ajst-32394	187	11	shap	shap	NOUN
ajst-32394	187	12	and	and	CCONJ
ajst-32394	187	13	lime	lime	NOUN
ajst-32394	187	14	poised	poise	VERB
ajst-32394	187	15	to	to	PART
ajst-32394	187	16	quantify	quantify	VERB
ajst-32394	187	17	feature	feature	NOUN
ajst-32394	187	18	contributions	contribution	NOUN
ajst-32394	187	19	in	in	ADP
ajst-32394	187	20	high	high	ADJ
ajst-32394	187	21	-	-	PUNCT
ajst-32394	187	22	stakes	stake	NOUN
ajst-32394	187	23	models	model	NOUN
ajst-32394	187	24	.	.	PUNCT
ajst-32394	188	1	in	in	ADP
ajst-32394	188	2	toxicant	toxicant	NOUN
ajst-32394	188	3	-	-	PUNCT
ajst-32394	188	4	induced	induce	VERB
ajst-32394	188	5	pathway	pathway	NOUN
ajst-32394	188	6	studies	study	NOUN
ajst-32394	188	7	,	,	PUNCT
ajst-32394	188	8	shap	shap	PROPN
ajst-32394	188	9	analyses	analysis	NOUN
ajst-32394	188	10	of	of	ADP
ajst-32394	188	11	cox	cox	PROPN
ajst-32394	188	12	regression	regression	NOUN
ajst-32394	188	13	ensembles	ensemble	NOUN
ajst-32394	188	14	reveal	reveal	VERB
ajst-32394	188	15	immune	immune	NOUN
ajst-32394	188	16	-	-	PUNCT
ajst-32394	188	17	related	relate	VERB
ajst-32394	188	18	drivers	driver	NOUN
ajst-32394	188	19	in	in	ADP
ajst-32394	188	20	pancreatic	pancreatic	ADJ
ajst-32394	188	21	cancer	cancer	NOUN
ajst-32394	188	22	heterogeneity	heterogeneity	NOUN
ajst-32394	188	23	,	,	PUNCT
ajst-32394	188	24	stratifying	stratify	VERB
ajst-32394	188	25	risks	risk	NOUN
ajst-32394	188	26	with	with	ADP
ajst-32394	188	27	85	85	NUM
ajst-32394	188	28	%	%	NOUN
ajst-32394	188	29	precision	precision	NOUN
ajst-32394	188	30	and	and	CCONJ
ajst-32394	188	31	guiding	guide	VERB
ajst-32394	188	32	immunotherapy	immunotherapy	NOUN
ajst-32394	188	33	selections	selection	NOUN
ajst-32394	188	34	[	[	X
ajst-32394	188	35	75	75	NUM
ajst-32394	188	36	]	]	PUNCT
ajst-32394	188	37	.	.	PUNCT
ajst-32394	189	1	future	future	ADJ
ajst-32394	189	2	efforts	effort	NOUN
ajst-32394	189	3	,	,	PUNCT
ajst-32394	189	4	per	per	ADP
ajst-32394	189	5	sciencedirect	sciencedirect	NOUN
ajst-32394	189	6	's	's	PART
ajst-32394	189	7	2025	2025	NUM
ajst-32394	189	8	synthesis	synthesis	NOUN
ajst-32394	189	9	,	,	PUNCT
ajst-32394	189	10	advocate	advocate	ADJ
ajst-32394	189	11	probing	probe	VERB
ajst-32394	189	12	-	-	PUNCT
ajst-32394	189	13	based	base	VERB
ajst-32394	189	14	xai	xai	NOUN
ajst-32394	189	15	for	for	ADP
ajst-32394	189	16	deep	deep	ADJ
ajst-32394	189	17	models	model	NOUN
ajst-32394	189	18	,	,	PUNCT
ajst-32394	189	19	simulating	simulate	VERB
ajst-32394	189	20	counterfactuals	counterfactual	NOUN
ajst-32394	189	21	to	to	PART
ajst-32394	189	22	abrogate	abrogate	VERB
ajst-32394	189	23	toxicity	toxicity	NOUN
ajst-32394	189	24	alerts	alert	NOUN
ajst-32394	189	25	—	—	PUNCT
ajst-32394	189	26	e.g.	e.g.	ADV
ajst-32394	189	27	,	,	PUNCT
ajst-32394	189	28	mutating	mutate	VERB
ajst-32394	189	29	electrophilic	electrophilic	ADJ
ajst-32394	189	30	warheads	warhead	NOUN
ajst-32394	189	31	in	in	ADP
ajst-32394	189	32	qsars	qsar	NOUN
ajst-32394	189	33	—	—	PUNCT
ajst-32394	189	34	yielding	yield	VERB
ajst-32394	189	35	20	20	NUM
ajst-32394	189	36	%	%	NOUN
ajst-32394	189	37	uplifts	uplift	VERB
ajst-32394	189	38	in	in	ADP
ajst-32394	189	39	mechanistic	mechanistic	ADJ
ajst-32394	189	40	fidelity	fidelity	NOUN
ajst-32394	189	41	.	.	PUNCT
ajst-32394	190	1	this	this	PRON
ajst-32394	190	2	will	will	AUX
ajst-32394	190	3	facilitate	facilitate	VERB
ajst-32394	190	4	fda	fda	PROPN
ajst-32394	190	5	audits	audits	NOUN
ajst-32394	190	6	,	,	PUNCT
ajst-32394	190	7	transitioning	transition	VERB
ajst-32394	190	8	ml	ml	X
ajst-32394	190	9	from	from	ADP
ajst-32394	190	10	advisory	advisory	NOUN
ajst-32394	190	11	to	to	ADP
ajst-32394	190	12	prescriptive	prescriptive	ADJ
ajst-32394	190	13	roles	role	NOUN
ajst-32394	190	14	in	in	ADP
ajst-32394	190	15	drug	drug	NOUN
ajst-32394	190	16	safety	safety	NOUN
ajst-32394	190	17	dossiers	dossier	NOUN
ajst-32394	190	18	.	.	PUNCT
ajst-32394	191	1	multi	multi	ADJ
ajst-32394	191	2	-	-	ADJ
ajst-32394	191	3	source	source	NOUN
ajst-32394	191	4	data	data	NOUN
ajst-32394	191	5	integration	integration	NOUN
ajst-32394	191	6	demands	demand	VERB
ajst-32394	191	7	sophisticated	sophisticated	ADJ
ajst-32394	191	8	fusions	fusion	NOUN
ajst-32394	191	9	,	,	PUNCT
ajst-32394	191	10	harmonizing	harmonize	VERB
ajst-32394	191	11	omics	omic	NOUN
ajst-32394	191	12	,	,	PUNCT
ajst-32394	191	13	imaging	imaging	NOUN
ajst-32394	191	14	,	,	PUNCT
ajst-32394	191	15	and	and	CCONJ
ajst-32394	191	16	exposomic	exposomic	ADJ
ajst-32394	191	17	strata	strata	NOUN
ajst-32394	191	18	via	via	ADP
ajst-32394	191	19	graph	graph	NOUN
ajst-32394	191	20	transformers	transformer	NOUN
ajst-32394	191	21	and	and	CCONJ
ajst-32394	191	22	variational	variational	ADJ
ajst-32394	191	23	autoencoders	autoencoder	NOUN
ajst-32394	191	24	(	(	PUNCT
ajst-32394	191	25	vaes	vaes	ADJ
ajst-32394	191	26	)	)	PUNCT
ajst-32394	191	27	.	.	PUNCT
ajst-32394	192	1	for	for	ADP
ajst-32394	192	2	drug	drug	NOUN
ajst-32394	192	3	-	-	PUNCT
ajst-32394	192	4	induced	induce	VERB
ajst-32394	192	5	liver	liver	NOUN
ajst-32394	192	6	injury	injury	NOUN
ajst-32394	192	7	(	(	PUNCT
ajst-32394	192	8	dili	dili	PROPN
ajst-32394	192	9	)	)	PUNCT
ajst-32394	192	10	,	,	PUNCT
ajst-32394	192	11	entropy	entropy	PROPN
ajst-32394	192	12	-	-	PUNCT
ajst-32394	192	13	weighted	weight	VERB
ajst-32394	192	14	ensembles	ensemble	NOUN
ajst-32394	192	15	integrate	integrate	VERB
ajst-32394	192	16	gene	gene	NOUN
ajst-32394	192	17	expression	expression	NOUN
ajst-32394	192	18	with	with	ADP
ajst-32394	192	19	metabolomics	metabolomic	NOUN
ajst-32394	192	20	,	,	PUNCT
ajst-32394	192	21	ranking	rank	VERB
ajst-32394	192	22	pathways	pathway	NOUN
ajst-32394	192	23	like	like	ADP
ajst-32394	192	24	nrf2	nrf2	NOUN
ajst-32394	192	25	activation	activation	NOUN
ajst-32394	192	26	at	at	ADP
ajst-32394	192	27	≥86	≥86	NOUN
ajst-32394	192	28	%	%	NOUN
ajst-32394	192	29	accuracy	accuracy	NOUN
ajst-32394	192	30	[	[	X
ajst-32394	192	31	76	76	NUM
ajst-32394	192	32	]	]	PUNCT
ajst-32394	192	33	.	.	PUNCT
ajst-32394	193	1	emerging	emerge	VERB
ajst-32394	193	2	2025	2025	NUM
ajst-32394	193	3	paradigms	paradigm	NOUN
ajst-32394	193	4	,	,	PUNCT
ajst-32394	193	5	as	as	ADP
ajst-32394	193	6	in	in	ADP
ajst-32394	193	7	acs	acs	PROPN
ajst-32394	193	8	's	's	PART
ajst-32394	193	9	computational	computational	ADJ
ajst-32394	193	10	tox	tox	NOUN
ajst-32394	193	11	review	review	NOUN
ajst-32394	193	12	,	,	PUNCT
ajst-32394	193	13	leverage	leverage	NOUN
ajst-32394	193	14	knowledge	knowledge	NOUN
ajst-32394	193	15	graphs	graph	NOUN
ajst-32394	193	16	to	to	PART
ajst-32394	193	17	validate	validate	VERB
ajst-32394	193	18	explanations	explanation	NOUN
ajst-32394	193	19	against	against	ADP
ajst-32394	193	20	biological	biological	ADJ
ajst-32394	193	21	priors	prior	NOUN
ajst-32394	193	22	,	,	PUNCT
ajst-32394	193	23	unmasking	unmask	VERB
ajst-32394	193	24	cross	cross	ADJ
ajst-32394	193	25	-	-	ADJ
ajst-32394	193	26	omics	omics	ADJ
ajst-32394	193	27	synergies	synergy	NOUN
ajst-32394	193	28	in	in	ADP
ajst-32394	193	29	obesogen	obesogen	PROPN
ajst-32394	193	30	cascades	cascade	NOUN
ajst-32394	193	31	with	with	ADP
ajst-32394	193	32	0.90	0.90	NUM
ajst-32394	193	33	aucs	aucs	NOUN
ajst-32394	193	34	.	.	PUNCT
ajst-32394	194	1	challenges	challenge	NOUN
ajst-32394	194	2	persist	persist	VERB
ajst-32394	194	3	in	in	ADP
ajst-32394	194	4	harmonizing	harmonize	VERB
ajst-32394	194	5	heterogeneous	heterogeneous	ADJ
ajst-32394	194	6	formats	format	NOUN
ajst-32394	194	7	,	,	PUNCT
ajst-32394	194	8	yet	yet	CCONJ
ajst-32394	194	9	federated	federated	ADJ
ajst-32394	194	10	learning	learning	NOUN
ajst-32394	194	11	promises	promise	VERB
ajst-32394	194	12	privacy	privacy	NOUN
ajst-32394	194	13	-	-	PUNCT
ajst-32394	194	14	preserving	preserve	VERB
ajst-32394	194	15	collaborations	collaboration	NOUN
ajst-32394	194	16	,	,	PUNCT
ajst-32394	194	17	pooling	pool	VERB
ajst-32394	194	18	global	global	ADJ
ajst-32394	194	19	consortia	consortium	NOUN
ajst-32394	194	20	for	for	ADP
ajst-32394	194	21	robust	robust	ADJ
ajst-32394	194	22	,	,	PUNCT
ajst-32394	194	23	generalizable	generalizable	ADJ
ajst-32394	194	24	models	model	NOUN
ajst-32394	194	25	.	.	PUNCT
ajst-32394	195	1	handling	handle	VERB
ajst-32394	195	2	complex	complex	ADJ
ajst-32394	195	3	interactions	interaction	NOUN
ajst-32394	195	4	—	—	PUNCT
ajst-32394	195	5	mixtures	mixture	NOUN
ajst-32394	195	6	,	,	PUNCT
ajst-32394	195	7	inter	inter	ADJ
ajst-32394	195	8	-	-	ADJ
ajst-32394	195	9	species	species	ADJ
ajst-32394	195	10	variances	variance	NOUN
ajst-32394	195	11	,	,	PUNCT
ajst-32394	195	12	and	and	CCONJ
ajst-32394	195	13	dose	dose	NOUN
ajst-32394	195	14	-	-	PUNCT
ajst-32394	195	15	responses	response	NOUN
ajst-32394	195	16	—	—	PUNCT
ajst-32394	195	17	necessitates	necessitate	VERB
ajst-32394	195	18	dynamic	dynamic	ADJ
ajst-32394	195	19	architectures	architecture	NOUN
ajst-32394	195	20	like	like	ADP
ajst-32394	195	21	reinforcement	reinforcement	NOUN
ajst-32394	195	22	learning	learning	NOUN
ajst-32394	195	23	(	(	PUNCT
ajst-32394	195	24	rl	rl	INTJ
ajst-32394	195	25	)	)	PUNCT
ajst-32394	195	26	on	on	ADP
ajst-32394	195	27	aop	aop	PROPN
ajst-32394	195	28	networks	network	NOUN
ajst-32394	195	29	.	.	PUNCT
ajst-32394	196	1	rl	rl	VERB
ajst-32394	196	2	simulates	simulate	NOUN
ajst-32394	196	3	co	co	NOUN
ajst-32394	196	4	-	-	NOUN
ajst-32394	196	5	exposures	exposure	NOUN
ajst-32394	196	6	,	,	PUNCT
ajst-32394	196	7	prognosticating	prognosticate	VERB
ajst-32394	196	8	synergistic	synergistic	ADJ
ajst-32394	196	9	toxicities	toxicity	NOUN
ajst-32394	196	10	at	at	ADP
ajst-32394	196	11	82	82	NUM
ajst-32394	196	12	%	%	NOUN
ajst-32394	196	13	fidelities	fidelity	NOUN
ajst-32394	196	14	,	,	PUNCT
ajst-32394	196	15	extensible	extensible	ADJ
ajst-32394	196	16	to	to	ADP
ajst-32394	196	17	cumulative	cumulative	ADJ
ajst-32394	196	18	risks	risk	NOUN
ajst-32394	196	19	in	in	ADP
ajst-32394	196	20	urban	urban	ADJ
ajst-32394	196	21	exposomes	exposome	NOUN
ajst-32394	196	22	[	[	X
ajst-32394	196	23	77	77	NUM
ajst-32394	196	24	]	]	PUNCT
ajst-32394	196	25	.	.	PUNCT
ajst-32394	197	1	as	as	SCONJ
ajst-32394	197	2	frontiers	frontier	NOUN
ajst-32394	197	3	'	'	PART
ajst-32394	197	4	2025	2025	NUM
ajst-32394	197	5	discourse	discourse	NOUN
ajst-32394	197	6	affirms	affirm	VERB
ajst-32394	197	7	,	,	PUNCT
ajst-32394	197	8	quantum	quantum	NOUN
ajst-32394	197	9	-	-	PUNCT
ajst-32394	197	10	accelerated	accelerate	VERB
ajst-32394	197	11	ml	ml	NOUN
ajst-32394	197	12	will	will	AUX
ajst-32394	197	13	enumerate	enumerate	VERB
ajst-32394	197	14	vast	vast	ADJ
ajst-32394	197	15	mixture	mixture	NOUN
ajst-32394	197	16	spaces	space	NOUN
ajst-32394	197	17	,	,	PUNCT
ajst-32394	197	18	while	while	SCONJ
ajst-32394	197	19	transfer	transfer	NOUN
ajst-32394	197	20	learning	learning	NOUN
ajst-32394	197	21	from	from	ADP
ajst-32394	197	22	animal	animal	NOUN
ajst-32394	197	23	proxies	proxy	NOUN
ajst-32394	197	24	imputes	impute	VERB
ajst-32394	197	25	human	human	ADJ
ajst-32394	197	26	variabilities	variability	NOUN
ajst-32394	197	27	,	,	PUNCT
ajst-32394	197	28	addressing	address	VERB
ajst-32394	197	29	ethical	ethical	ADJ
ajst-32394	197	30	data	datum	NOUN
ajst-32394	197	31	voids	void	NOUN
ajst-32394	197	32	.	.	PUNCT
ajst-32394	198	1	validation	validation	NOUN
ajst-32394	198	2	via	via	ADP
ajst-32394	198	3	prospective	prospective	ADJ
ajst-32394	198	4	cohorts	cohort	NOUN
ajst-32394	198	5	and	and	CCONJ
ajst-32394	198	6	benchmarking	benchmarke	VERB
ajst-32394	198	7	datasets	dataset	NOUN
ajst-32394	198	8	remains	remain	VERB
ajst-32394	198	9	crucial	crucial	ADJ
ajst-32394	198	10	for	for	ADP
ajst-32394	198	11	reliability	reliability	NOUN
ajst-32394	198	12	.	.	PUNCT
ajst-32394	199	1	13	13	NUM
ajst-32394	199	2	.	.	X
ajst-32394	199	3	conclusion	conclusion	VERB
ajst-32394	199	4	the	the	DET
ajst-32394	199	5	utilization	utilization	NOUN
ajst-32394	199	6	of	of	ADP
ajst-32394	199	7	machine	machine	NOUN
ajst-32394	199	8	learning	learn	VERB
ajst-32394	199	9	within	within	ADP
ajst-32394	199	10	computational	computational	ADJ
ajst-32394	199	11	toxicology	toxicology	NOUN
ajst-32394	199	12	has	have	AUX
ajst-32394	199	13	increasingly	increasingly	ADV
ajst-32394	199	14	advanced	advance	VERB
ajst-32394	199	15	,	,	PUNCT
ajst-32394	199	16	especially	especially	ADV
ajst-32394	199	17	through	through	ADP
ajst-32394	199	18	its	its	PRON
ajst-32394	199	19	convergence	convergence	NOUN
ajst-32394	199	20	with	with	ADP
ajst-32394	199	21	network	network	NOUN
ajst-32394	199	22	toxicology	toxicology	NOUN
ajst-32394	199	23	.	.	PUNCT
ajst-32394	200	1	this	this	DET
ajst-32394	200	2	integration	integration	NOUN
ajst-32394	200	3	has	have	AUX
ajst-32394	200	4	enabled	enable	VERB
ajst-32394	200	5	more	more	ADV
ajst-32394	200	6	accurate	accurate	ADJ
ajst-32394	200	7	and	and	CCONJ
ajst-32394	200	8	efficient	efficient	ADJ
ajst-32394	200	9	toxicological	toxicological	ADJ
ajst-32394	200	10	predictions	prediction	NOUN
ajst-32394	200	11	and	and	CCONJ
ajst-32394	200	12	mechanistic	mechanistic	ADJ
ajst-32394	200	13	insights	insight	NOUN
ajst-32394	200	14	.	.	PUNCT
ajst-32394	201	1	additionally	additionally	ADV
ajst-32394	201	2	,	,	PUNCT
ajst-32394	201	3	it	it	PRON
ajst-32394	201	4	has	have	AUX
ajst-32394	201	5	significantly	significantly	ADV
ajst-32394	201	6	diminished	diminish	VERB
ajst-32394	201	7	the	the	DET
ajst-32394	201	8	dependence	dependence	NOUN
ajst-32394	201	9	on	on	ADP
ajst-32394	201	10	conventional	conventional	ADJ
ajst-32394	201	11	animal	animal	NOUN
ajst-32394	201	12	testing	testing	NOUN
ajst-32394	201	13	,	,	PUNCT
ajst-32394	201	14	thereby	thereby	ADV
ajst-32394	201	15	supporting	support	VERB
ajst-32394	201	16	the	the	DET
ajst-32394	201	17	contemporary	contemporary	ADJ
ajst-32394	201	18	toxicological	toxicological	ADJ
ajst-32394	201	19	objective	objective	NOUN
ajst-32394	201	20	of	of	ADP
ajst-32394	201	21	adhering	adhere	VERB
ajst-32394	201	22	to	to	ADP
ajst-32394	201	23	the	the	DET
ajst-32394	201	24	"	"	PUNCT
ajst-32394	201	25	3r	3r	NUM
ajst-32394	201	26	principles	principle	NOUN
ajst-32394	201	27	"	"	PUNCT
ajst-32394	201	28	(	(	PUNCT
ajst-32394	201	29	replacement	replacement	NOUN
ajst-32394	201	30	,	,	PUNCT
ajst-32394	201	31	reduction	reduction	NOUN
ajst-32394	201	32	,	,	PUNCT
ajst-32394	201	33	and	and	CCONJ
ajst-32394	201	34	refinement	refinement	NOUN
ajst-32394	201	35	)	)	PUNCT
ajst-32394	201	36	.	.	PUNCT
ajst-32394	202	1	this	this	DET
ajst-32394	202	2	article	article	NOUN
ajst-32394	202	3	provides	provide	VERB
ajst-32394	202	4	a	a	DET
ajst-32394	202	5	systematic	systematic	ADJ
ajst-32394	202	6	review	review	NOUN
ajst-32394	202	7	of	of	ADP
ajst-32394	202	8	recent	recent	ADJ
ajst-32394	202	9	research	research	NOUN
ajst-32394	202	10	developments	development	NOUN
ajst-32394	202	11	in	in	ADP
ajst-32394	202	12	the	the	DET
ajst-32394	202	13	application	application	NOUN
ajst-32394	202	14	of	of	ADP
ajst-32394	202	15	machine	machine	NOUN
ajst-32394	202	16	learning	learn	VERB
ajst-32394	202	17	across	across	ADP
ajst-32394	202	18	diverse	diverse	ADJ
ajst-32394	202	19	areas	area	NOUN
ajst-32394	202	20	,	,	PUNCT
ajst-32394	202	21	including	include	VERB
ajst-32394	202	22	toxicity	toxicity	NOUN
ajst-32394	202	23	risk	risk	NOUN
ajst-32394	202	24	assessment	assessment	NOUN
ajst-32394	202	25	,	,	PUNCT
ajst-32394	202	26	toxicant	toxicant	ADJ
ajst-32394	202	27	–	–	PUNCT
ajst-32394	202	28	target	target	NOUN
ajst-32394	202	29	interaction	interaction	NOUN
ajst-32394	202	30	analysis	analysis	NOUN
ajst-32394	202	31	,	,	PUNCT
ajst-32394	202	32	biomarker	biomarker	NOUN
ajst-32394	202	33	discovery	discovery	NOUN
ajst-32394	202	34	,	,	PUNCT
ajst-32394	202	35	high	high	ADJ
ajst-32394	202	36	-	-	PUNCT
ajst-32394	202	37	throughput	throughput	NOUN
ajst-32394	202	38	screening	screening	NOUN
ajst-32394	202	39	,	,	PUNCT
ajst-32394	202	40	and	and	CCONJ
ajst-32394	202	41	the	the	DET
ajst-32394	202	42	identification	identification	NOUN
ajst-32394	202	43	of	of	ADP
ajst-32394	202	44	toxicity	toxicity	NOUN
ajst-32394	202	45	pathways	pathway	NOUN
ajst-32394	202	46	.	.	PUNCT
ajst-32394	203	1	machine	machine	NOUN
ajst-32394	203	2	learning	learn	VERB
ajst-32394	203	3	synthesizes	synthesize	VERB
ajst-32394	203	4	diverse	diverse	ADJ
ajst-32394	203	5	,	,	PUNCT
ajst-32394	203	6	multi	multi	ADJ
ajst-32394	203	7	-	-	ADJ
ajst-32394	203	8	source	source	ADJ
ajst-32394	203	9	data	datum	NOUN
ajst-32394	203	10	—	—	PUNCT
ajst-32394	203	11	including	include	VERB
ajst-32394	203	12	genomic	genomic	NOUN
ajst-32394	203	13	,	,	PUNCT
ajst-32394	203	14	proteomic	proteomic	NOUN
ajst-32394	203	15	,	,	PUNCT
ajst-32394	203	16	metabolomic	metabolomic	ADJ
ajst-32394	203	17	,	,	PUNCT
ajst-32394	203	18	and	and	CCONJ
ajst-32394	203	19	imaging	imaging	NOUN
ajst-32394	203	20	datasets	dataset	NOUN
ajst-32394	203	21	—	—	PUNCT
ajst-32394	203	22	to	to	PART
ajst-32394	203	23	develop	develop	VERB
ajst-32394	203	24	more	more	ADV
ajst-32394	203	25	comprehensive	comprehensive	ADJ
ajst-32394	203	26	and	and	CCONJ
ajst-32394	203	27	dynamic	dynamic	ADJ
ajst-32394	203	28	models	model	NOUN
ajst-32394	203	29	for	for	ADP
ajst-32394	203	30	toxicity	toxicity	NOUN
ajst-32394	203	31	assessment	assessment	NOUN
ajst-32394	203	32	.	.	PUNCT
ajst-32394	204	1	for	for	ADP
ajst-32394	204	2	example	example	NOUN
ajst-32394	204	3	,	,	PUNCT
ajst-32394	204	4	in	in	ADP
ajst-32394	204	5	predicting	predict	VERB
ajst-32394	204	6	specific	specific	ADJ
ajst-32394	204	7	endpoints	endpoint	NOUN
ajst-32394	204	8	such	such	ADJ
ajst-32394	204	9	as	as	ADP
ajst-32394	204	10	hepatotoxicity	hepatotoxicity	NOUN
ajst-32394	204	11	,	,	PUNCT
ajst-32394	204	12	skin	skin	NOUN
ajst-32394	204	13	sensitization	sensitization	NOUN
ajst-32394	204	14	,	,	PUNCT
ajst-32394	204	15	and	and	CCONJ
ajst-32394	204	16	neurotoxicity	neurotoxicity	NOUN
ajst-32394	204	17	,	,	PUNCT
ajst-32394	204	18	advanced	advanced	ADJ
ajst-32394	204	19	modeling	modeling	NOUN
ajst-32394	204	20	techniques	technique	NOUN
ajst-32394	204	21	,	,	PUNCT
ajst-32394	204	22	including	include	VERB
ajst-32394	204	23	ensemble	ensemble	ADJ
ajst-32394	204	24	learning	learning	NOUN
ajst-32394	204	25	and	and	CCONJ
ajst-32394	204	26	deep	deep	ADJ
ajst-32394	204	27	learning	learning	NOUN
ajst-32394	204	28	,	,	PUNCT
ajst-32394	204	29	have	have	AUX
ajst-32394	204	30	exhibited	exhibit	VERB
ajst-32394	204	31	outstanding	outstanding	ADJ
ajst-32394	204	32	performance	performance	NOUN
ajst-32394	204	33	.	.	PUNCT
ajst-32394	205	1	these	these	DET
ajst-32394	205	2	advancements	advancement	NOUN
ajst-32394	205	3	enable	enable	VERB
ajst-32394	205	4	the	the	DET
ajst-32394	205	5	identification	identification	NOUN
ajst-32394	205	6	of	of	ADP
ajst-32394	205	7	key	key	ADJ
ajst-32394	205	8	toxicological	toxicological	ADJ
ajst-32394	205	9	structural	structural	ADJ
ajst-32394	205	10	domains	domain	NOUN
ajst-32394	205	11	and	and	CCONJ
ajst-32394	205	12	biological	biological	ADJ
ajst-32394	205	13	pathways	pathway	NOUN
ajst-32394	205	14	,	,	PUNCT
ajst-32394	205	15	thereby	thereby	ADV
ajst-32394	205	16	advancing	advance	VERB
ajst-32394	205	17	the	the	DET
ajst-32394	205	18	transition	transition	NOUN
ajst-32394	205	19	from	from	ADP
ajst-32394	205	20	a	a	DET
ajst-32394	205	21	“	"	PUNCT
ajst-32394	205	22	black	black	ADJ
ajst-32394	205	23	-	-	PUNCT
ajst-32394	205	24	box	box	NOUN
ajst-32394	205	25	prediction	prediction	NOUN
ajst-32394	205	26	”	"	PUNCT
ajst-32394	205	27	approach	approach	NOUN
ajst-32394	205	28	to	to	ADP
ajst-32394	205	29	a	a	DET
ajst-32394	205	30	“	"	PUNCT
ajst-32394	205	31	mechanism	mechanism	NOUN
ajst-32394	205	32	-	-	PUNCT
ajst-32394	205	33	driven	drive	VERB
ajst-32394	205	34	”	"	PUNCT
ajst-32394	205	35	paradigm	paradigm	NOUN
ajst-32394	205	36	.	.	PUNCT
ajst-32394	206	1	while	while	SCONJ
ajst-32394	206	2	machine	machine	NOUN
ajst-32394	206	3	learning	learn	VERB
ajst-32394	206	4	exhibits	exhibit	VERB
ajst-32394	206	5	considerable	considerable	ADJ
ajst-32394	206	6	potential	potential	NOUN
ajst-32394	206	7	in	in	ADP
ajst-32394	206	8	the	the	DET
ajst-32394	206	9	field	field	NOUN
ajst-32394	206	10	of	of	ADP
ajst-32394	206	11	toxicology	toxicology	NOUN
ajst-32394	206	12	,	,	PUNCT
ajst-32394	206	13	it	it	PRON
ajst-32394	206	14	continues	continue	VERB
ajst-32394	206	15	to	to	PART
ajst-32394	206	16	encounter	encounter	VERB
ajst-32394	206	17	a	a	DET
ajst-32394	206	18	range	range	NOUN
ajst-32394	206	19	of	of	ADP
ajst-32394	206	20	challenges	challenge	NOUN
ajst-32394	206	21	.	.	PUNCT
ajst-32394	207	1	issues	issue	NOUN
ajst-32394	207	2	such	such	ADJ
ajst-32394	207	3	as	as	ADP
ajst-32394	207	4	model	model	NOUN
ajst-32394	207	5	interpretability	interpretability	NOUN
ajst-32394	207	6	,	,	PUNCT
ajst-32394	207	7	data	datum	NOUN
ajst-32394	207	8	quality	quality	NOUN
ajst-32394	207	9	and	and	CCONJ
ajst-32394	207	10	bias	bias	NOUN
ajst-32394	207	11	,	,	PUNCT
ajst-32394	207	12	and	and	CCONJ
ajst-32394	207	13	the	the	DET
ajst-32394	207	14	reliability	reliability	NOUN
ajst-32394	207	15	of	of	ADP
ajst-32394	207	16	cross	cross	ADJ
ajst-32394	207	17	-	-	ADJ
ajst-32394	207	18	species	species	ADJ
ajst-32394	207	19	extrapolation	extrapolation	NOUN
ajst-32394	207	20	necessitate	necessitate	ADJ
ajst-32394	207	21	further	further	ADJ
ajst-32394	207	22	investigation	investigation	NOUN
ajst-32394	207	23	and	and	CCONJ
ajst-32394	207	24	resolution	resolution	NOUN
ajst-32394	207	25	.	.	PUNCT
ajst-32394	208	1	moreover	moreover	ADV
ajst-32394	208	2	,	,	PUNCT
ajst-32394	208	3	211	211	NUM
ajst-32394	208	4	ethical	ethical	ADJ
ajst-32394	208	5	and	and	CCONJ
ajst-32394	208	6	regulatory	regulatory	ADJ
ajst-32394	208	7	frameworks	framework	NOUN
ajst-32394	208	8	must	must	AUX
ajst-32394	208	9	evolve	evolve	VERB
ajst-32394	208	10	concurrently	concurrently	ADV
ajst-32394	208	11	with	with	ADP
ajst-32394	208	12	technological	technological	ADJ
ajst-32394	208	13	advancements	advancement	NOUN
ajst-32394	208	14	to	to	PART
ajst-32394	208	15	ensure	ensure	VERB
ajst-32394	208	16	that	that	SCONJ
ajst-32394	208	17	machine	machine	NOUN
ajst-32394	208	18	learning	learning	NOUN
ajst-32394	208	19	models	model	NOUN
ajst-32394	208	20	are	be	AUX
ajst-32394	208	21	employed	employ	VERB
ajst-32394	208	22	in	in	ADP
ajst-32394	208	23	risk	risk	NOUN
ajst-32394	208	24	assessment	assessment	NOUN
ajst-32394	208	25	and	and	CCONJ
ajst-32394	208	26	decision	decision	NOUN
ajst-32394	208	27	-	-	PUNCT
ajst-32394	208	28	making	make	VERB
ajst-32394	208	29	processes	process	NOUN
ajst-32394	208	30	within	within	ADP
ajst-32394	208	31	environments	environment	NOUN
ajst-32394	208	32	that	that	PRON
ajst-32394	208	33	are	be	AUX
ajst-32394	208	34	compliant	compliant	ADJ
ajst-32394	208	35	,	,	PUNCT
ajst-32394	208	36	equitable	equitable	ADJ
ajst-32394	208	37	,	,	PUNCT
ajst-32394	208	38	and	and	CCONJ
ajst-32394	208	39	transparent	transparent	ADJ
ajst-32394	208	40	.	.	PUNCT
ajst-32394	209	1	looking	look	VERB
ajst-32394	209	2	forward	forward	ADV
ajst-32394	209	3	,	,	PUNCT
ajst-32394	209	4	with	with	ADP
ajst-32394	209	5	the	the	DET
ajst-32394	209	6	advent	advent	NOUN
ajst-32394	209	7	of	of	ADP
ajst-32394	209	8	various	various	ADJ
ajst-32394	209	9	innovative	innovative	ADJ
ajst-32394	209	10	technologies	technology	NOUN
ajst-32394	209	11	,	,	PUNCT
ajst-32394	209	12	the	the	DET
ajst-32394	209	13	application	application	NOUN
ajst-32394	209	14	of	of	ADP
ajst-32394	209	15	machine	machine	NOUN
ajst-32394	209	16	learning	learning	NOUN
ajst-32394	209	17	in	in	ADP
ajst-32394	209	18	toxicology	toxicology	NOUN
ajst-32394	209	19	is	be	AUX
ajst-32394	209	20	expected	expect	VERB
ajst-32394	209	21	to	to	PART
ajst-32394	209	22	increasingly	increasingly	ADV
ajst-32394	209	23	emphasize	emphasize	VERB
ajst-32394	209	24	multimodal	multimodal	ADJ
ajst-32394	209	25	data	datum	NOUN
ajst-32394	209	26	integration	integration	NOUN
ajst-32394	209	27	,	,	PUNCT
ajst-32394	209	28	dynamic	dynamic	ADJ
ajst-32394	209	29	system	system	NOUN
ajst-32394	209	30	modeling	modeling	NOUN
ajst-32394	209	31	,	,	PUNCT
ajst-32394	209	32	and	and	CCONJ
ajst-32394	209	33	real	real	ADJ
ajst-32394	209	34	-	-	PUNCT
ajst-32394	209	35	time	time	NOUN
ajst-32394	209	36	risk	risk	NOUN
ajst-32394	209	37	monitoring	monitoring	NOUN
ajst-32394	209	38	.	.	PUNCT
ajst-32394	210	1	machine	machine	NOUN
ajst-32394	210	2	learning	learning	NOUN
ajst-32394	210	3	will	will	AUX
ajst-32394	210	4	not	not	PART
ajst-32394	210	5	only	only	ADV
ajst-32394	210	6	enhance	enhance	VERB
ajst-32394	210	7	the	the	DET
ajst-32394	210	8	precision	precision	NOUN
ajst-32394	210	9	of	of	ADP
ajst-32394	210	10	toxicity	toxicity	NOUN
ajst-32394	210	11	predictions	prediction	NOUN
ajst-32394	210	12	but	but	CCONJ
ajst-32394	210	13	also	also	ADV
ajst-32394	210	14	provide	provide	VERB
ajst-32394	210	15	deeper	deep	ADJ
ajst-32394	210	16	insights	insight	NOUN
ajst-32394	210	17	into	into	ADP
ajst-32394	210	18	the	the	DET
ajst-32394	210	19	molecular	molecular	ADJ
ajst-32394	210	20	mechanisms	mechanism	NOUN
ajst-32394	210	21	underlying	underlie	VERB
ajst-32394	210	22	toxic	toxic	ADJ
ajst-32394	210	23	effects	effect	NOUN
ajst-32394	210	24	.	.	PUNCT
ajst-32394	211	1	this	this	DET
ajst-32394	211	2	progression	progression	NOUN
ajst-32394	211	3	will	will	AUX
ajst-32394	211	4	facilitate	facilitate	VERB
ajst-32394	211	5	the	the	DET
ajst-32394	211	6	transformation	transformation	NOUN
ajst-32394	211	7	of	of	ADP
ajst-32394	211	8	toxicology	toxicology	NOUN
ajst-32394	211	9	from	from	ADP
ajst-32394	211	10	a	a	DET
ajst-32394	211	11	descriptive	descriptive	ADJ
ajst-32394	211	12	science	science	NOUN
ajst-32394	211	13	into	into	ADP
ajst-32394	211	14	a	a	DET
ajst-32394	211	15	predictive	predictive	ADJ
ajst-32394	211	16	and	and	CCONJ
ajst-32394	211	17	preventive	preventive	ADJ
ajst-32394	211	18	discipline	discipline	NOUN
ajst-32394	211	19	,	,	PUNCT
ajst-32394	211	20	ultimately	ultimately	ADV
ajst-32394	211	21	offering	offer	VERB
ajst-32394	211	22	robust	robust	ADJ
ajst-32394	211	23	support	support	NOUN
ajst-32394	211	24	for	for	ADP
ajst-32394	211	25	precision	precision	NOUN
ajst-32394	211	26	chemical	chemical	NOUN
ajst-32394	211	27	safety	safety	NOUN
ajst-32394	211	28	management	management	NOUN
ajst-32394	211	29	and	and	CCONJ
ajst-32394	211	30	the	the	DET
ajst-32394	211	31	protection	protection	NOUN
ajst-32394	211	32	of	of	ADP
ajst-32394	211	33	human	human	ADJ
ajst-32394	211	34	health	health	NOUN
ajst-32394	211	35	.	.	PUNCT
ajst-32394	212	1	references	reference	NOUN
ajst-32394	212	2	[	[	X
ajst-32394	212	3	1	1	NUM
ajst-32394	212	4	]	]	PUNCT
ajst-32394	212	5	rusyn	rusyn	NOUN
ajst-32394	212	6	,	,	PUNCT
ajst-32394	212	7	i.	i.	PROPN
ajst-32394	212	8	,	,	PUNCT
ajst-32394	212	9	sedykh	sedykh	ADJ
ajst-32394	212	10	,	,	PUNCT
ajst-32394	212	11	a.	a.	NOUN
ajst-32394	212	12	,	,	PUNCT
ajst-32394	212	13	low	low	ADJ
ajst-32394	212	14	,	,	PUNCT
ajst-32394	212	15	y.	y.	PROPN
ajst-32394	212	16	,	,	PUNCT
ajst-32394	212	17	guyton	guyton	PROPN
ajst-32394	212	18	,	,	PUNCT
ajst-32394	212	19	k.	k.	PROPN
ajst-32394	212	20	z.	z.	PROPN
ajst-32394	212	21	,	,	PUNCT
ajst-32394	212	22	&	&	CCONJ
ajst-32394	212	23	tropsha	tropsha	PROPN
ajst-32394	212	24	,	,	PUNCT
ajst-32394	212	25	a.	a.	NOUN
ajst-32394	212	26	(	(	PUNCT
ajst-32394	212	27	2012	2012	NUM
ajst-32394	212	28	)	)	PUNCT
ajst-32394	212	29	.	.	PUNCT
ajst-32394	213	1	predictive	predictive	ADJ
ajst-32394	213	2	modeling	modeling	NOUN
ajst-32394	213	3	of	of	ADP
ajst-32394	213	4	chemical	chemical	ADJ
ajst-32394	213	5	hazard	hazard	NOUN
ajst-32394	213	6	by	by	ADP
ajst-32394	213	7	integrating	integrate	VERB
ajst-32394	213	8	numerical	numerical	ADJ
ajst-32394	213	9	descriptors	descriptor	NOUN
ajst-32394	213	10	of	of	ADP
ajst-32394	213	11	chemical	chemical	NOUN
ajst-32394	213	12	structures	structure	NOUN
ajst-32394	213	13	and	and	CCONJ
ajst-32394	213	14	short	short	ADJ
ajst-32394	213	15	-	-	PUNCT
ajst-32394	213	16	term	term	NOUN
ajst-32394	213	17	toxicity	toxicity	NOUN
ajst-32394	213	18	assay	assay	NOUN
ajst-32394	213	19	data	datum	NOUN
ajst-32394	213	20	.	.	PUNCT
ajst-32394	214	1	toxicological	toxicological	ADJ
ajst-32394	214	2	sciences	science	NOUN
ajst-32394	214	3	,	,	PUNCT
ajst-32394	214	4	127(1	127(1	NUM
ajst-32394	214	5	)	)	PUNCT
ajst-32394	214	6	,	,	PUNCT
ajst-32394	214	7	1–9	1–9	NOUN
ajst-32394	214	8	.	.	PUNCT
ajst-32394	215	1	[	[	X
ajst-32394	215	2	2	2	NUM
ajst-32394	215	3	]	]	PUNCT
ajst-32394	215	4	luechtefeld	luechtefeld	PROPN
ajst-32394	215	5	,	,	PUNCT
ajst-32394	215	6	t.	t.	PROPN
ajst-32394	215	7	,	,	PUNCT
ajst-32394	215	8	rowlands	rowlands	PROPN
ajst-32394	215	9	,	,	PUNCT
ajst-32394	215	10	c.	c.	PROPN
ajst-32394	215	11	,	,	PUNCT
ajst-32394	215	12	&	&	CCONJ
ajst-32394	215	13	hartung	hartung	PROPN
ajst-32394	215	14	,	,	PUNCT
ajst-32394	215	15	t.	t.	PROPN
ajst-32394	215	16	(	(	PUNCT
ajst-32394	215	17	2018	2018	NUM
ajst-32394	215	18	)	)	PUNCT
ajst-32394	215	19	.	.	PUNCT
ajst-32394	216	1	machine	machine	NOUN
ajst-32394	216	2	learning	learn	VERB
ajst-32394	216	3	in	in	ADP
ajst-32394	216	4	toxicology	toxicology	NOUN
ajst-32394	216	5	:	:	PUNCT
ajst-32394	216	6	a	a	DET
ajst-32394	216	7	new	new	ADJ
ajst-32394	216	8	paradigm	paradigm	NOUN
ajst-32394	216	9	for	for	ADP
ajst-32394	216	10	risk	risk	NOUN
ajst-32394	216	11	assessment	assessment	NOUN
ajst-32394	216	12	.	.	PUNCT
ajst-32394	217	1	altex	altex	PROPN
ajst-32394	217	2	,	,	PUNCT
ajst-32394	217	3	35(3	35(3	NUM
ajst-32394	217	4	)	)	PUNCT
ajst-32394	217	5	,	,	PUNCT
ajst-32394	217	6	347–360	347–360	NUM
ajst-32394	217	7	.	.	PUNCT
ajst-32394	218	1	[	[	X
ajst-32394	218	2	3	3	NUM
ajst-32394	218	3	]	]	X
ajst-32394	218	4	bozdag	bozdag	NOUN
ajst-32394	218	5	,	,	PUNCT
ajst-32394	218	6	s.	s.	PROPN
ajst-32394	218	7	,	,	PUNCT
ajst-32394	218	8	merrill	merrill	PROPN
ajst-32394	218	9	,	,	PUNCT
ajst-32394	218	10	s.	s.	PROPN
ajst-32394	218	11	j.	j.	PROPN
ajst-32394	218	12	,	,	PUNCT
ajst-32394	218	13	povinelli	povinelli	PROPN
ajst-32394	218	14	,	,	PUNCT
ajst-32394	218	15	r.	r.	PROPN
ajst-32394	218	16	j.	j.	PROPN
ajst-32394	218	17	,	,	PUNCT
ajst-32394	218	18	&	&	CCONJ
ajst-32394	218	19	toussaint	toussaint	PROPN
ajst-32394	218	20	,	,	PUNCT
ajst-32394	218	21	k.	k.	PROPN
ajst-32394	218	22	c.	c.	PROPN
ajst-32394	218	23	(	(	PUNCT
ajst-32394	218	24	2016	2016	NUM
ajst-32394	218	25	)	)	PUNCT
ajst-32394	218	26	.	.	PUNCT
ajst-32394	219	1	novel	novel	PROPN
ajst-32394	219	2	uses	use	NOUN
ajst-32394	219	3	of	of	ADP
ajst-32394	219	4	in	in	ADP
ajst-32394	219	5	vitro	vitro	X
ajst-32394	219	6	data	datum	NOUN
ajst-32394	219	7	to	to	PART
ajst-32394	219	8	develop	develop	VERB
ajst-32394	219	9	quantitative	quantitative	ADJ
ajst-32394	219	10	biological	biological	ADJ
ajst-32394	219	11	activity	activity	NOUN
ajst-32394	219	12	relationship	relationship	NOUN
ajst-32394	219	13	models	model	NOUN
ajst-32394	219	14	for	for	ADP
ajst-32394	219	15	in	in	ADP
ajst-32394	219	16	vivo	vivo	ADJ
ajst-32394	219	17	carcinogenicity	carcinogenicity	NOUN
ajst-32394	219	18	prediction	prediction	NOUN
ajst-32394	219	19	.	.	PUNCT
ajst-32394	220	1	molecular	molecular	ADJ
ajst-32394	220	2	informatics	informatic	NOUN
ajst-32394	220	3	,	,	PUNCT
ajst-32394	220	4	35(5	35(5	NUM
ajst-32394	220	5	)	)	PUNCT
ajst-32394	220	6	,	,	PUNCT
ajst-32394	220	7	236–245	236–245	NUM
ajst-32394	220	8	.	.	PUNCT
ajst-32394	221	1	[	[	X
ajst-32394	221	2	4	4	NUM
ajst-32394	221	3	]	]	SYM
ajst-32394	221	4	clark	clark	NOUN
ajst-32394	221	5	,	,	PUNCT
ajst-32394	221	6	a.	a.	NOUN
ajst-32394	221	7	m.	m.	NOUN
ajst-32394	221	8	,	,	PUNCT
ajst-32394	221	9	dole	dole	PROPN
ajst-32394	221	10	,	,	PUNCT
ajst-32394	221	11	k.	k.	PROPN
ajst-32394	221	12	,	,	PUNCT
ajst-32394	221	13	coulon	coulon	NOUN
ajst-32394	221	14	-	-	PUNCT
ajst-32394	221	15	spektor	spektor	NOUN
ajst-32394	221	16	,	,	PUNCT
ajst-32394	221	17	a.	a.	PROPN
ajst-32394	221	18	,	,	PUNCT
ajst-32394	221	19	et	et	PROPN
ajst-32394	221	20	al	al	PROPN
ajst-32394	221	21	.	.	PUNCT
ajst-32394	222	1	(	(	PUNCT
ajst-32394	222	2	2015	2015	NUM
ajst-32394	222	3	)	)	PUNCT
ajst-32394	222	4	.	.	PUNCT
ajst-32394	223	1	open	open	ADJ
ajst-32394	223	2	source	source	NOUN
ajst-32394	223	3	bayesian	bayesian	NOUN
ajst-32394	223	4	models	model	NOUN
ajst-32394	223	5	.	.	PUNCT
ajst-32394	224	1	1	1	X
ajst-32394	224	2	.	.	X
ajst-32394	224	3	application	application	NOUN
ajst-32394	224	4	to	to	ADP
ajst-32394	224	5	adme	adme	NOUN
ajst-32394	224	6	/	/	SYM
ajst-32394	224	7	tox	tox	NOUN
ajst-32394	224	8	and	and	CCONJ
ajst-32394	224	9	drug	drug	NOUN
ajst-32394	224	10	discovery	discovery	NOUN
ajst-32394	224	11	datasets	dataset	NOUN
ajst-32394	224	12	.	.	PUNCT
ajst-32394	225	1	journal	journal	PROPN
ajst-32394	225	2	of	of	ADP
ajst-32394	225	3	chemical	chemical	ADJ
ajst-32394	225	4	information	information	NOUN
ajst-32394	225	5	and	and	CCONJ
ajst-32394	225	6	modeling	modeling	NOUN
ajst-32394	225	7	,	,	PUNCT
ajst-32394	225	8	55(6	55(6	NUM
ajst-32394	225	9	)	)	PUNCT
ajst-32394	225	10	,	,	PUNCT
ajst-32394	225	11	1231	1231	NUM
ajst-32394	225	12	–	–	PUNCT
ajst-32394	225	13	1245	1245	NUM
ajst-32394	225	14	.	.	PUNCT
ajst-32394	226	1	[	[	X
ajst-32394	226	2	5	5	NUM
ajst-32394	226	3	]	]	X
ajst-32394	226	4	jeanray	jeanray	NOUN
ajst-32394	226	5	,	,	PUNCT
ajst-32394	226	6	n.	n.	NOUN
ajst-32394	226	7	,	,	PUNCT
ajst-32394	226	8	marée	marée	NOUN
ajst-32394	226	9	,	,	PUNCT
ajst-32394	226	10	r.	r.	PROPN
ajst-32394	226	11	,	,	PUNCT
ajst-32394	226	12	pruvot	pruvot	NOUN
ajst-32394	226	13	,	,	PUNCT
ajst-32394	226	14	b.	b.	PROPN
ajst-32394	226	15	,	,	PUNCT
ajst-32394	226	16	et	et	PROPN
ajst-32394	226	17	al	al	PROPN
ajst-32394	226	18	.	.	PUNCT
ajst-32394	227	1	(	(	PUNCT
ajst-32394	227	2	2015	2015	NUM
ajst-32394	227	3	)	)	PUNCT
ajst-32394	227	4	.	.	PUNCT
ajst-32394	228	1	phenotype	phenotype	NOUN
ajst-32394	228	2	classification	classification	NOUN
ajst-32394	228	3	of	of	ADP
ajst-32394	228	4	zebrafish	zebrafish	ADJ
ajst-32394	228	5	embryos	embryo	NOUN
ajst-32394	228	6	by	by	ADP
ajst-32394	228	7	supervised	supervised	ADJ
ajst-32394	228	8	learning	learning	NOUN
ajst-32394	228	9	.	.	PUNCT
ajst-32394	229	1	plos	plos	PROPN
ajst-32394	229	2	one	one	NUM
ajst-32394	229	3	,	,	PUNCT
ajst-32394	229	4	10(1	10(1	NUM
ajst-32394	229	5	)	)	PUNCT
ajst-32394	229	6	,	,	PUNCT
ajst-32394	229	7	e0116989	e0116989	PROPN
ajst-32394	229	8	.	.	PUNCT
ajst-32394	230	1	[	[	X
ajst-32394	230	2	6	6	NUM
ajst-32394	230	3	]	]	X
ajst-32394	230	4	bozdag	bozdag	NOUN
ajst-32394	230	5	,	,	PUNCT
ajst-32394	230	6	s.	s.	PROPN
ajst-32394	230	7	,	,	PUNCT
ajst-32394	230	8	merrill	merrill	PROPN
ajst-32394	230	9	,	,	PUNCT
ajst-32394	230	10	s.	s.	PROPN
ajst-32394	230	11	j.	j.	PROPN
ajst-32394	230	12	,	,	PUNCT
ajst-32394	230	13	povinelli	povinelli	PROPN
ajst-32394	230	14	,	,	PUNCT
ajst-32394	230	15	r.	r.	PROPN
ajst-32394	230	16	j.	j.	PROPN
ajst-32394	230	17	,	,	PUNCT
ajst-32394	230	18	&	&	CCONJ
ajst-32394	230	19	toussaint	toussaint	PROPN
ajst-32394	230	20	,	,	PUNCT
ajst-32394	230	21	k.	k.	PROPN
ajst-32394	230	22	c.	c.	PROPN
ajst-32394	230	23	(	(	PUNCT
ajst-32394	230	24	2016	2016	NUM
ajst-32394	230	25	)	)	PUNCT
ajst-32394	230	26	.	.	PUNCT
ajst-32394	231	1	qbar	qbar	NOUN
ajst-32394	231	2	:	:	PUNCT
ajst-32394	231	3	a	a	DET
ajst-32394	231	4	quantitative	quantitative	ADJ
ajst-32394	231	5	biological	biological	ADJ
ajst-32394	231	6	activity	activity	NOUN
ajst-32394	231	7	relationship	relationship	NOUN
ajst-32394	231	8	model	model	NOUN
ajst-32394	231	9	for	for	ADP
ajst-32394	231	10	predicting	predict	VERB
ajst-32394	231	11	carcinogenicity	carcinogenicity	NOUN
ajst-32394	231	12	.	.	PUNCT
ajst-32394	232	1	chemical	chemical	ADJ
ajst-32394	232	2	research	research	NOUN
ajst-32394	232	3	in	in	ADP
ajst-32394	232	4	toxicology	toxicology	NOUN
ajst-32394	232	5	,	,	PUNCT
ajst-32394	232	6	29(5	29(5	NUM
ajst-32394	232	7	)	)	PUNCT
ajst-32394	232	8	,	,	PUNCT
ajst-32394	232	9	836	836	NUM
ajst-32394	232	10	–	–	PUNCT
ajst-32394	232	11	845	845	NUM
ajst-32394	232	12	.	.	PUNCT
ajst-32394	233	1	[	[	X
ajst-32394	233	2	7	7	NUM
ajst-32394	233	3	]	]	X
ajst-32394	233	4	banerjee	banerjee	PROPN
ajst-32394	233	5	,	,	PUNCT
ajst-32394	233	6	p.	p.	NOUN
ajst-32394	233	7	,	,	PUNCT
ajst-32394	233	8	siramshetty	siramshetty	PROPN
ajst-32394	233	9	,	,	PUNCT
ajst-32394	233	10	v.	v.	PROPN
ajst-32394	233	11	b.	b.	PROPN
ajst-32394	233	12	,	,	PUNCT
ajst-32394	233	13	drwal	drwal	PROPN
ajst-32394	233	14	,	,	PUNCT
ajst-32394	233	15	m.	m.	NOUN
ajst-32394	233	16	n.	n.	PROPN
ajst-32394	233	17	,	,	PUNCT
ajst-32394	233	18	&	&	CCONJ
ajst-32394	233	19	preissner	preissner	PROPN
ajst-32394	233	20	,	,	PUNCT
ajst-32394	233	21	r.	r.	PROPN
ajst-32394	233	22	(	(	PUNCT
ajst-32394	233	23	2017	2017	NUM
ajst-32394	233	24	)	)	PUNCT
ajst-32394	233	25	.	.	PUNCT
ajst-32394	234	1	computational	computational	ADJ
ajst-32394	234	2	methods	method	NOUN
ajst-32394	234	3	for	for	ADP
ajst-32394	234	4	prediction	prediction	NOUN
ajst-32394	234	5	of	of	ADP
ajst-32394	234	6	in	in	ADP
ajst-32394	234	7	vitro	vitro	X
ajst-32394	234	8	effects	effect	NOUN
ajst-32394	234	9	of	of	ADP
ajst-32394	234	10	new	new	ADJ
ajst-32394	234	11	chemical	chemical	NOUN
ajst-32394	234	12	structures	structure	NOUN
ajst-32394	234	13	.	.	PUNCT
ajst-32394	235	1	journal	journal	NOUN
ajst-32394	235	2	of	of	ADP
ajst-32394	235	3	cheminformatics	cheminformatic	NOUN
ajst-32394	235	4	,	,	PUNCT
ajst-32394	235	5	9(1	9(1	NUM
ajst-32394	235	6	)	)	PUNCT
ajst-32394	235	7	,	,	PUNCT
ajst-32394	235	8	1–15	1–15	NUM
ajst-32394	235	9	.	.	PUNCT
ajst-32394	236	1	[	[	X
ajst-32394	236	2	8	8	NUM
ajst-32394	236	3	]	]	PUNCT
ajst-32394	236	4	luechtefeld	luechtefeld	PROPN
ajst-32394	236	5	,	,	PUNCT
ajst-32394	236	6	t.	t.	PROPN
ajst-32394	236	7	,	,	PUNCT
ajst-32394	236	8	rowlands	rowlands	PROPN
ajst-32394	236	9	,	,	PUNCT
ajst-32394	236	10	c.	c.	PROPN
ajst-32394	236	11	,	,	PUNCT
ajst-32394	236	12	&	&	CCONJ
ajst-32394	236	13	hartung	hartung	PROPN
ajst-32394	236	14	,	,	PUNCT
ajst-32394	236	15	t.	t.	PROPN
ajst-32394	236	16	(	(	PUNCT
ajst-32394	236	17	2018	2018	NUM
ajst-32394	236	18	)	)	PUNCT
ajst-32394	236	19	.	.	PUNCT
ajst-32394	237	1	big	big	ADJ
ajst-32394	237	2	-	-	PUNCT
ajst-32394	237	3	data	datum	NOUN
ajst-32394	237	4	and	and	CCONJ
ajst-32394	237	5	machine	machine	NOUN
ajst-32394	237	6	learning	learn	VERB
ajst-32394	237	7	to	to	PART
ajst-32394	237	8	revamp	revamp	VERB
ajst-32394	237	9	computational	computational	ADJ
ajst-32394	237	10	toxicology	toxicology	NOUN
ajst-32394	237	11	and	and	CCONJ
ajst-32394	237	12	its	its	PRON
ajst-32394	237	13	use	use	NOUN
ajst-32394	237	14	in	in	ADP
ajst-32394	237	15	risk	risk	NOUN
ajst-32394	237	16	assessment	assessment	NOUN
ajst-32394	237	17	.	.	PUNCT
ajst-32394	238	1	toxicology	toxicology	NOUN
ajst-32394	238	2	research	research	NOUN
ajst-32394	238	3	,	,	PUNCT
ajst-32394	238	4	7(3	7(3	NUM
ajst-32394	238	5	)	)	PUNCT
ajst-32394	238	6	,	,	PUNCT
ajst-32394	238	7	732–744	732–744	NUM
ajst-32394	238	8	.	.	PUNCT
ajst-32394	239	1	[	[	X
ajst-32394	239	2	9	9	NUM
ajst-32394	239	3	]	]	PUNCT
ajst-32394	239	4	luechtefeld	luechtefeld	PROPN
ajst-32394	239	5	,	,	PUNCT
ajst-32394	239	6	t.	t.	PROPN
ajst-32394	239	7	,	,	PUNCT
ajst-32394	239	8	marsh	marsh	PROPN
ajst-32394	239	9	,	,	PUNCT
ajst-32394	239	10	d.	d.	PROPN
ajst-32394	239	11	,	,	PUNCT
ajst-32394	239	12	rowlands	rowlands	PROPN
ajst-32394	239	13	,	,	PUNCT
ajst-32394	239	14	c.	c.	PROPN
ajst-32394	239	15	,	,	PUNCT
ajst-32394	239	16	&	&	CCONJ
ajst-32394	239	17	hartung	hartung	PROPN
ajst-32394	239	18	,	,	PUNCT
ajst-32394	239	19	t.	t.	PROPN
ajst-32394	239	20	(	(	PUNCT
ajst-32394	239	21	2018	2018	NUM
ajst-32394	239	22	)	)	PUNCT
ajst-32394	239	23	.	.	PUNCT
ajst-32394	240	1	machine	machine	NOUN
ajst-32394	240	2	learning	learning	NOUN
ajst-32394	240	3	of	of	ADP
ajst-32394	240	4	toxicological	toxicological	ADJ
ajst-32394	240	5	big	big	ADJ
ajst-32394	240	6	data	datum	NOUN
ajst-32394	240	7	enables	enable	VERB
ajst-32394	240	8	osar	osar	ADJ
ajst-32394	240	9	for	for	ADP
ajst-32394	240	10	risk	risk	NOUN
ajst-32394	240	11	assessment	assessment	NOUN
ajst-32394	240	12	.	.	PUNCT
ajst-32394	241	1	nature	nature	NOUN
ajst-32394	241	2	communications	communication	NOUN
ajst-32394	241	3	,	,	PUNCT
ajst-32394	241	4	9(1	9(1	NUM
ajst-32394	241	5	)	)	PUNCT
ajst-32394	241	6	,	,	PUNCT
ajst-32394	241	7	5318	5318	NUM
ajst-32394	241	8	.	.	PUNCT
ajst-32394	242	1	[	[	X
ajst-32394	242	2	10	10	NUM
ajst-32394	242	3	]	]	PUNCT
ajst-32394	242	4	luechtefeld	luechtefeld	PROPN
ajst-32394	242	5	,	,	PUNCT
ajst-32394	242	6	t.	t.	PROPN
ajst-32394	242	7	,	,	PUNCT
ajst-32394	242	8	rowlands	rowlands	PROPN
ajst-32394	242	9	,	,	PUNCT
ajst-32394	242	10	c.	c.	PROPN
ajst-32394	242	11	,	,	PUNCT
ajst-32394	242	12	hartung	hartung	PROPN
ajst-32394	242	13	,	,	PUNCT
ajst-32394	242	14	t.	t.	PROPN
ajst-32394	242	15	,	,	PUNCT
ajst-32394	242	16	&	&	CCONJ
ajst-32394	242	17	maertens	maertens	PROPN
ajst-32394	242	18	,	,	PUNCT
ajst-32394	242	19	a.	a.	NOUN
ajst-32394	242	20	(	(	PUNCT
ajst-32394	242	21	2018	2018	NUM
ajst-32394	242	22	)	)	PUNCT
ajst-32394	242	23	.	.	PUNCT
ajst-32394	243	1	machine	machine	NOUN
ajst-32394	243	2	learning	learn	VERB
ajst-32394	243	3	in	in	ADP
ajst-32394	243	4	predictive	predictive	ADJ
ajst-32394	243	5	toxicology	toxicology	NOUN
ajst-32394	243	6	:	:	PUNCT
ajst-32394	243	7	recent	recent	ADJ
ajst-32394	243	8	applications	application	NOUN
ajst-32394	243	9	and	and	CCONJ
ajst-32394	243	10	future	future	ADJ
ajst-32394	243	11	directions	direction	NOUN
ajst-32394	243	12	.	.	PUNCT
ajst-32394	244	1	altex	altex	NOUN
ajst-32394	244	2	,	,	PUNCT
ajst-32394	244	3	35(4	35(4	PROPN
ajst-32394	244	4	)	)	PUNCT
ajst-32394	244	5	,	,	PUNCT
ajst-32394	244	6	453–468	453–468	NUM
ajst-32394	244	7	.	.	PUNCT
ajst-32394	245	1	[	[	X
ajst-32394	245	2	11	11	NUM
ajst-32394	245	3	]	]	X
ajst-32394	245	4	ballabio	ballabio	PROPN
ajst-32394	245	5	,	,	PUNCT
ajst-32394	245	6	d.	d.	PROPN
ajst-32394	245	7	,	,	PUNCT
ajst-32394	245	8	bonati	bonati	PROPN
ajst-32394	245	9	,	,	PUNCT
ajst-32394	245	10	l.	l.	PROPN
ajst-32394	245	11	,	,	PUNCT
ajst-32394	245	12	grisoni	grisoni	PROPN
ajst-32394	245	13	,	,	PUNCT
ajst-32394	245	14	f.	f.	PROPN
ajst-32394	245	15	,	,	PUNCT
ajst-32394	245	16	et	et	PROPN
ajst-32394	245	17	al	al	PROPN
ajst-32394	245	18	.	.	PROPN
ajst-32394	245	19	(	(	PUNCT
ajst-32394	245	20	2020	2020	NUM
ajst-32394	245	21	)	)	PUNCT
ajst-32394	245	22	.	.	PUNCT
ajst-32394	246	1	nura	nura	PROPN
ajst-32394	246	2	:	:	PUNCT
ajst-32394	246	3	a	a	DET
ajst-32394	246	4	curated	curate	VERB
ajst-32394	246	5	dataset	dataset	NOUN
ajst-32394	246	6	of	of	ADP
ajst-32394	246	7	nuclear	nuclear	ADJ
ajst-32394	246	8	receptor	receptor	NOUN
ajst-32394	246	9	modulators	modulator	NOUN
ajst-32394	246	10	.	.	PUNCT
ajst-32394	247	1	toxicology	toxicology	NOUN
ajst-32394	247	2	and	and	CCONJ
ajst-32394	247	3	applied	apply	VERB
ajst-32394	247	4	pharmacology	pharmacology	NOUN
ajst-32394	247	5	,	,	PUNCT
ajst-32394	247	6	402	402	NUM
ajst-32394	247	7	,	,	PUNCT
ajst-32394	247	8	115108	115108	NUM
ajst-32394	247	9	.	.	PUNCT
ajst-32394	248	1	[	[	X
ajst-32394	248	2	12	12	NUM
ajst-32394	248	3	]	]	PUNCT
ajst-32394	248	4	ekins	ekin	NOUN
ajst-32394	248	5	,	,	PUNCT
ajst-32394	248	6	s.	s.	PROPN
ajst-32394	248	7	(	(	PUNCT
ajst-32394	248	8	2007	2007	NUM
ajst-32394	248	9	)	)	PUNCT
ajst-32394	248	10	.	.	PUNCT
ajst-32394	249	1	computational	computational	ADJ
ajst-32394	249	2	toxicology	toxicology	NOUN
ajst-32394	249	3	:	:	PUNCT
ajst-32394	249	4	risk	risk	NOUN
ajst-32394	249	5	assessment	assessment	NOUN
ajst-32394	249	6	for	for	ADP
ajst-32394	249	7	pharmaceutical	pharmaceutical	ADJ
ajst-32394	249	8	and	and	CCONJ
ajst-32394	249	9	environmental	environmental	ADJ
ajst-32394	249	10	chemicals	chemical	NOUN
ajst-32394	249	11	.	.	PUNCT
ajst-32394	250	1	john	john	PROPN
ajst-32394	250	2	wiley	wiley	PROPN
ajst-32394	250	3	&	&	CCONJ
ajst-32394	250	4	sons	son	NOUN
ajst-32394	250	5	.	.	PUNCT
ajst-32394	251	1	[	[	X
ajst-32394	251	2	13	13	NUM
ajst-32394	251	3	]	]	X
ajst-32394	251	4	ballabio	ballabio	PROPN
ajst-32394	251	5	,	,	PUNCT
ajst-32394	251	6	d.	d.	PROPN
ajst-32394	251	7	,	,	PUNCT
ajst-32394	251	8	grisoni	grisoni	PROPN
ajst-32394	251	9	,	,	PUNCT
ajst-32394	251	10	f.	f.	PROPN
ajst-32394	251	11	,	,	PUNCT
ajst-32394	251	12	consonni	consonni	PROPN
ajst-32394	251	13	,	,	PUNCT
ajst-32394	251	14	v.	v.	ADV
ajst-32394	251	15	,	,	PUNCT
ajst-32394	251	16	&	&	CCONJ
ajst-32394	251	17	todeschini	todeschini	PROPN
ajst-32394	251	18	,	,	PUNCT
ajst-32394	251	19	r.	r.	PROPN
ajst-32394	251	20	(	(	PUNCT
ajst-32394	251	21	2020	2020	NUM
ajst-32394	251	22	)	)	PUNCT
ajst-32394	251	23	.	.	PUNCT
ajst-32394	252	1	integrated	integrate	VERB
ajst-32394	252	2	qsar	qsar	NOUN
ajst-32394	252	3	models	model	NOUN
ajst-32394	252	4	for	for	ADP
ajst-32394	252	5	predicting	predict	VERB
ajst-32394	252	6	nuclear	nuclear	ADJ
ajst-32394	252	7	receptor	receptor	NOUN
ajst-32394	252	8	activity	activity	NOUN
ajst-32394	252	9	.	.	PUNCT
ajst-32394	253	1	chemosphere	chemosphere	PROPN
ajst-32394	253	2	,	,	PUNCT
ajst-32394	253	3	246	246	NUM
ajst-32394	253	4	,	,	PUNCT
ajst-32394	253	5	125741	125741	NUM
ajst-32394	253	6	.	.	PUNCT
ajst-32394	254	1	[	[	X
ajst-32394	254	2	14	14	NUM
ajst-32394	254	3	]	]	X
ajst-32394	254	4	banerjee	banerjee	PROPN
ajst-32394	254	5	,	,	PUNCT
ajst-32394	254	6	p.	p.	PROPN
ajst-32394	254	7	,	,	PUNCT
ajst-32394	254	8	eckert	eckert	PROPN
ajst-32394	254	9	,	,	PUNCT
ajst-32394	254	10	a.	a.	PROPN
ajst-32394	254	11	o.	o.	PROPN
ajst-32394	254	12	,	,	PUNCT
ajst-32394	254	13	schrey	schrey	PROPN
ajst-32394	254	14	,	,	PUNCT
ajst-32394	254	15	a.	a.	PROPN
ajst-32394	254	16	k.	k.	PROPN
ajst-32394	254	17	,	,	PUNCT
ajst-32394	254	18	&	&	CCONJ
ajst-32394	254	19	preissner	preissner	PROPN
ajst-32394	254	20	,	,	PUNCT
ajst-32394	254	21	r.	r.	PROPN
ajst-32394	254	22	(	(	PUNCT
ajst-32394	254	23	2017	2017	NUM
ajst-32394	254	24	)	)	PUNCT
ajst-32394	254	25	.	.	PUNCT
ajst-32394	255	1	protox	protox	PROPN
ajst-32394	255	2	-	-	PUNCT
ajst-32394	255	3	ii	ii	PROPN
ajst-32394	255	4	:	:	PUNCT
ajst-32394	255	5	a	a	DET
ajst-32394	255	6	webserver	webserver	NOUN
ajst-32394	255	7	for	for	ADP
ajst-32394	255	8	the	the	DET
ajst-32394	255	9	prediction	prediction	NOUN
ajst-32394	255	10	of	of	ADP
ajst-32394	255	11	toxicity	toxicity	NOUN
ajst-32394	255	12	of	of	ADP
ajst-32394	255	13	chemicals	chemical	NOUN
ajst-32394	255	14	.	.	PUNCT
ajst-32394	256	1	nucleic	nucleic	ADJ
ajst-32394	256	2	acids	acid	NOUN
ajst-32394	256	3	research	research	NOUN
ajst-32394	256	4	,	,	PUNCT
ajst-32394	256	5	46(w1	46(w1	NUM
ajst-32394	256	6	)	)	PUNCT
ajst-32394	256	7	,	,	PUNCT
ajst-32394	256	8	w257	w257	PROPN
ajst-32394	256	9	–	–	PUNCT
ajst-32394	256	10	w263	w263	NUM
ajst-32394	256	11	.	.	PUNCT
ajst-32394	257	1	[	[	X
ajst-32394	257	2	15	15	NUM
ajst-32394	257	3	]	]	X
ajst-32394	257	4	charest	char	ADJ
ajst-32394	257	5	,	,	PUNCT
ajst-32394	257	6	n.	n.	PROPN
ajst-32394	257	7	,	,	PUNCT
ajst-32394	257	8	lowe	lowe	PROPN
ajst-32394	257	9	,	,	PUNCT
ajst-32394	257	10	c.	c.	PROPN
ajst-32394	257	11	n.	n.	PROPN
ajst-32394	257	12	,	,	PUNCT
ajst-32394	257	13	ramsland	ramsland	NOUN
ajst-32394	257	14	,	,	PUNCT
ajst-32394	257	15	c.	c.	PROPN
ajst-32394	257	16	,	,	PUNCT
ajst-32394	257	17	&	&	CCONJ
ajst-32394	257	18	yargeau	yargeau	PROPN
ajst-32394	257	19	,	,	PUNCT
ajst-32394	257	20	v.	v.	PROPN
ajst-32394	257	21	(	(	PUNCT
ajst-32394	257	22	2024	2024	NUM
ajst-32394	257	23	)	)	PUNCT
ajst-32394	257	24	.	.	PUNCT
ajst-32394	258	1	improving	improve	VERB
ajst-32394	258	2	predictions	prediction	NOUN
ajst-32394	258	3	of	of	ADP
ajst-32394	258	4	compound	compound	NOUN
ajst-32394	258	5	amenability	amenability	NOUN
ajst-32394	258	6	for	for	ADP
ajst-32394	258	7	liquid	liquid	ADJ
ajst-32394	258	8	chromatography	chromatography	NOUN
ajst-32394	258	9	–	–	PUNCT
ajst-32394	258	10	mass	mass	NOUN
ajst-32394	258	11	spectrometry	spectrometry	NOUN
ajst-32394	258	12	to	to	PART
ajst-32394	258	13	enhance	enhance	VERB
ajst-32394	258	14	non	non	ADJ
ajst-32394	258	15	-	-	ADJ
ajst-32394	258	16	targeted	targeted	ADJ
ajst-32394	258	17	analysis	analysis	NOUN
ajst-32394	258	18	.	.	PUNCT
ajst-32394	259	1	analytical	analytical	ADJ
ajst-32394	259	2	and	and	CCONJ
ajst-32394	259	3	bioanalytical	bioanalytical	ADJ
ajst-32394	259	4	chemistry	chemistry	NOUN
ajst-32394	259	5	,	,	PUNCT
ajst-32394	259	6	416(5	416(5	NUM
ajst-32394	259	7	)	)	PUNCT
ajst-32394	259	8	,	,	PUNCT
ajst-32394	259	9	1123–1135	1123–1135	NUM
ajst-32394	259	10	.	.	PUNCT
ajst-32394	260	1	[	[	X
ajst-32394	260	2	16	16	NUM
ajst-32394	260	3	]	]	X
ajst-32394	260	4	raseta	raseta	NOUN
ajst-32394	260	5	,	,	PUNCT
ajst-32394	260	6	m.	m.	NOUN
ajst-32394	260	7	,	,	PUNCT
ajst-32394	260	8	pitchford	pitchford	NOUN
ajst-32394	260	9	,	,	PUNCT
ajst-32394	260	10	j.	j.	PROPN
ajst-32394	260	11	,	,	PUNCT
ajst-32394	260	12	cussens	cussens	PROPN
ajst-32394	260	13	,	,	PUNCT
ajst-32394	260	14	j.	j.	PROPN
ajst-32394	260	15	,	,	PUNCT
ajst-32394	260	16	&	&	CCONJ
ajst-32394	260	17	roberts	roberts	PROPN
ajst-32394	260	18	,	,	PUNCT
ajst-32394	260	19	i.	i.	PROPN
ajst-32394	260	20	(	(	PUNCT
ajst-32394	260	21	2025	2025	NUM
ajst-32394	260	22	)	)	PUNCT
ajst-32394	260	23	.	.	PUNCT
ajst-32394	261	1	integrated	integrate	VERB
ajst-32394	261	2	testing	testing	NOUN
ajst-32394	261	3	strategies	strategy	NOUN
ajst-32394	261	4	for	for	ADP
ajst-32394	261	5	cost	cost	NOUN
ajst-32394	261	6	-	-	PUNCT
ajst-32394	261	7	sensitive	sensitive	ADJ
ajst-32394	261	8	time	time	NOUN
ajst-32394	261	9	-	-	PUNCT
ajst-32394	261	10	efficient	efficient	ADJ
ajst-32394	261	11	hazard	hazard	NOUN
ajst-32394	261	12	classification	classification	NOUN
ajst-32394	261	13	of	of	ADP
ajst-32394	261	14	new	new	ADJ
ajst-32394	261	15	chemicals	chemical	NOUN
ajst-32394	261	16	:	:	PUNCT
ajst-32394	261	17	the	the	DET
ajst-32394	261	18	case	case	NOUN
ajst-32394	261	19	of	of	ADP
ajst-32394	261	20	skin	skin	NOUN
ajst-32394	261	21	sensitization	sensitization	NOUN
ajst-32394	261	22	.	.	PUNCT
ajst-32394	262	1	risk	risk	NOUN
ajst-32394	262	2	analysis	analysis	NOUN
ajst-32394	262	3	,	,	PUNCT
ajst-32394	262	4	45(2	45(2	NOUN
ajst-32394	262	5	)	)	PUNCT
ajst-32394	262	6	,	,	PUNCT
ajst-32394	262	7	345–356	345–356	NUM
ajst-32394	262	8	.	.	PUNCT
ajst-32394	263	1	212	212	NUM
ajst-32394	263	2	[	[	SYM
ajst-32394	263	3	17	17	NUM
ajst-32394	263	4	]	]	X
ajst-32394	263	5	bai	bai	PROPN
ajst-32394	263	6	,	,	PUNCT
ajst-32394	263	7	y.	y.	PROPN
ajst-32394	263	8	(	(	PUNCT
ajst-32394	263	9	2025	2025	NUM
ajst-32394	263	10	)	)	PUNCT
ajst-32394	263	11	.	.	PUNCT
ajst-32394	264	1	federated	federated	ADJ
ajst-32394	264	2	learning	learning	NOUN
ajst-32394	264	3	in	in	ADP
ajst-32394	264	4	multi	multi	ADJ
ajst-32394	264	5	-	-	ADJ
ajst-32394	264	6	institutional	institutional	ADJ
ajst-32394	264	7	toxicology	toxicology	NOUN
ajst-32394	264	8	data	datum	NOUN
ajst-32394	264	9	integration	integration	NOUN
ajst-32394	264	10	:	:	PUNCT
ajst-32394	264	11	challenges	challenge	NOUN
ajst-32394	264	12	and	and	CCONJ
ajst-32394	264	13	opportunities	opportunity	NOUN
ajst-32394	264	14	.	.	PUNCT
ajst-32394	265	1	computational	computational	ADJ
ajst-32394	265	2	toxicology	toxicology	NOUN
ajst-32394	265	3	,	,	PUNCT
ajst-32394	265	4	21	21	NUM
ajst-32394	265	5	,	,	PUNCT
ajst-32394	265	6	100218	100218	NUM
ajst-32394	265	7	.	.	PUNCT
ajst-32394	266	1	[	[	X
ajst-32394	266	2	18	18	NUM
ajst-32394	266	3	]	]	X
ajst-32394	266	4	jia	jia	PROPN
ajst-32394	266	5	,	,	PUNCT
ajst-32394	266	6	x.	x.	PROPN
ajst-32394	266	7	,	,	PUNCT
ajst-32394	266	8	liu	liu	PROPN
ajst-32394	266	9	,	,	PUNCT
ajst-32394	266	10	y.	y.	PROPN
ajst-32394	266	11	,	,	PUNCT
ajst-32394	266	12	zhang	zhang	PROPN
ajst-32394	266	13	,	,	PUNCT
ajst-32394	266	14	l.	l.	PROPN
ajst-32394	266	15	,	,	PUNCT
ajst-32394	266	16	&	&	CCONJ
ajst-32394	266	17	wang	wang	PROPN
ajst-32394	266	18	,	,	PUNCT
ajst-32394	266	19	h.	h.	PROPN
ajst-32394	266	20	(	(	PUNCT
ajst-32394	266	21	2023	2023	NUM
ajst-32394	266	22	)	)	PUNCT
ajst-32394	266	23	.	.	PUNCT
ajst-32394	267	1	graph	graph	NOUN
ajst-32394	267	2	neural	neural	ADJ
ajst-32394	267	3	networks	network	NOUN
ajst-32394	267	4	for	for	ADP
ajst-32394	267	5	probabilistic	probabilistic	ADJ
ajst-32394	267	6	adverse	adverse	ADJ
ajst-32394	267	7	outcome	outcome	NOUN
ajst-32394	267	8	pathway	pathway	NOUN
ajst-32394	267	9	modeling	modeling	NOUN
ajst-32394	267	10	in	in	ADP
ajst-32394	267	11	network	network	NOUN
ajst-32394	267	12	toxicology	toxicology	NOUN
ajst-32394	267	13	.	.	PUNCT
ajst-32394	268	1	environmental	environmental	ADJ
ajst-32394	268	2	science	science	PROPN
ajst-32394	268	3	&	&	CCONJ
ajst-32394	268	4	technology	technology	NOUN
ajst-32394	268	5	,	,	PUNCT
ajst-32394	268	6	57(12	57(12	NUM
ajst-32394	268	7	)	)	PUNCT
ajst-32394	268	8	,	,	PUNCT
ajst-32394	268	9	4981–4992	4981–4992	NUM
ajst-32394	268	10	.	.	PUNCT
ajst-32394	269	1	[	[	X
ajst-32394	269	2	19	19	NUM
ajst-32394	269	3	]	]	X
ajst-32394	269	4	chen	chen	PROPN
ajst-32394	269	5	,	,	PUNCT
ajst-32394	269	6	m.	m.	NOUN
ajst-32394	269	7	,	,	PUNCT
ajst-32394	269	8	hong	hong	PROPN
ajst-32394	269	9	,	,	PUNCT
ajst-32394	269	10	h.	h.	PROPN
ajst-32394	269	11	,	,	PUNCT
ajst-32394	269	12	judson	judson	PROPN
ajst-32394	269	13	,	,	PUNCT
ajst-32394	269	14	r.	r.	PROPN
ajst-32394	269	15	s.	s.	PROPN
ajst-32394	269	16	,	,	PUNCT
ajst-32394	269	17	et	et	PROPN
ajst-32394	269	18	al	al	PROPN
ajst-32394	269	19	.	.	PUNCT
ajst-32394	269	20	(	(	PUNCT
ajst-32394	269	21	2015	2015	NUM
ajst-32394	269	22	)	)	PUNCT
ajst-32394	269	23	.	.	PUNCT
ajst-32394	270	1	predicting	predict	VERB
ajst-32394	270	2	hepatotoxicity	hepatotoxicity	NOUN
ajst-32394	270	3	using	use	VERB
ajst-32394	270	4	toxcast	toxcast	NOUN
ajst-32394	270	5	in	in	ADP
ajst-32394	270	6	vitro	vitro	X
ajst-32394	270	7	bioactivity	bioactivity	NOUN
ajst-32394	270	8	and	and	CCONJ
ajst-32394	270	9	chemical	chemical	NOUN
ajst-32394	270	10	structure	structure	NOUN
ajst-32394	270	11	.	.	PUNCT
ajst-32394	271	1	chemical	chemical	ADJ
ajst-32394	271	2	research	research	NOUN
ajst-32394	271	3	in	in	ADP
ajst-32394	271	4	toxicology	toxicology	NOUN
ajst-32394	271	5	,	,	PUNCT
ajst-32394	271	6	28(4	28(4	NUM
ajst-32394	271	7	)	)	PUNCT
ajst-32394	271	8	,	,	PUNCT
ajst-32394	271	9	738–751	738–751	NUM
ajst-32394	271	10	.	.	PUNCT
ajst-32394	272	1	[	[	X
ajst-32394	272	2	20	20	NUM
ajst-32394	272	3	]	]	X
ajst-32394	272	4	chen	chen	PROPN
ajst-32394	272	5	,	,	PUNCT
ajst-32394	272	6	m.	m.	NOUN
ajst-32394	272	7	,	,	PUNCT
ajst-32394	272	8	zhang	zhang	PROPN
ajst-32394	272	9	,	,	PUNCT
ajst-32394	272	10	j.	j.	PROPN
ajst-32394	272	11	,	,	PUNCT
ajst-32394	272	12	wang	wang	PROPN
ajst-32394	272	13	,	,	PUNCT
ajst-32394	272	14	y.	y.	PROPN
ajst-32394	272	15	,	,	PUNCT
ajst-32394	272	16	&	&	CCONJ
ajst-32394	272	17	zhu	zhu	PROPN
ajst-32394	272	18	,	,	PUNCT
ajst-32394	272	19	h.	h.	PROPN
ajst-32394	272	20	(	(	PUNCT
ajst-32394	272	21	2015	2015	NUM
ajst-32394	272	22	)	)	PUNCT
ajst-32394	272	23	.	.	PUNCT
ajst-32394	273	1	machine	machine	NOUN
ajst-32394	273	2	learning	learn	VERB
ajst-32394	273	3	in	in	ADP
ajst-32394	273	4	predictive	predictive	ADJ
ajst-32394	273	5	toxicology	toxicology	NOUN
ajst-32394	273	6	:	:	PUNCT
ajst-32394	273	7	recent	recent	ADJ
ajst-32394	273	8	advances	advance	NOUN
ajst-32394	273	9	and	and	CCONJ
ajst-32394	273	10	future	future	ADJ
ajst-32394	273	11	prospects	prospect	NOUN
ajst-32394	273	12	.	.	PUNCT
ajst-32394	274	1	toxicology	toxicology	NOUN
ajst-32394	274	2	letters	letter	NOUN
ajst-32394	274	3	,	,	PUNCT
ajst-32394	274	4	240(2	240(2	NUM
ajst-32394	274	5	)	)	PUNCT
ajst-32394	274	6	,	,	PUNCT
ajst-32394	274	7	180–192	180–192	NUM
ajst-32394	274	8	.	.	PUNCT
ajst-32394	275	1	[	[	X
ajst-32394	275	2	21	21	NUM
ajst-32394	275	3	]	]	X
ajst-32394	275	4	chen	chen	PROPN
ajst-32394	275	5	,	,	PUNCT
ajst-32394	275	6	m.	m.	NOUN
ajst-32394	275	7	,	,	PUNCT
ajst-32394	275	8	vijayaraghavan	vijayaraghavan	NOUN
ajst-32394	275	9	,	,	PUNCT
ajst-32394	275	10	r.	r.	PROPN
ajst-32394	275	11	,	,	PUNCT
ajst-32394	275	12	he	he	PRON
ajst-32394	275	13	,	,	PUNCT
ajst-32394	275	14	s.	s.	PROPN
ajst-32394	275	15	,	,	PUNCT
ajst-32394	275	16	et	et	PROPN
ajst-32394	275	17	al	al	PROPN
ajst-32394	275	18	.	.	PUNCT
ajst-32394	275	19	(	(	PUNCT
ajst-32394	275	20	2015	2015	NUM
ajst-32394	275	21	)	)	PUNCT
ajst-32394	275	22	.	.	PUNCT
ajst-32394	276	1	a	a	DET
ajst-32394	276	2	comprehensive	comprehensive	ADJ
ajst-32394	276	3	survey	survey	NOUN
ajst-32394	276	4	of	of	ADP
ajst-32394	276	5	machine	machine	NOUN
ajst-32394	276	6	learning	learning	NOUN
ajst-32394	276	7	methods	method	NOUN
ajst-32394	276	8	in	in	ADP
ajst-32394	276	9	toxicogenomics	toxicogenomic	NOUN
ajst-32394	276	10	.	.	PUNCT
ajst-32394	277	1	briefings	briefing	NOUN
ajst-32394	277	2	in	in	ADP
ajst-32394	277	3	bioinformatics	bioinformatics	NOUN
ajst-32394	277	4	,	,	PUNCT
ajst-32394	277	5	16(5	16(5	NUM
ajst-32394	277	6	)	)	PUNCT
ajst-32394	277	7	,	,	PUNCT
ajst-32394	277	8	769–780	769–780	NUM
ajst-32394	277	9	.	.	PUNCT
ajst-32394	278	1	[	[	X
ajst-32394	278	2	22	22	NUM
ajst-32394	278	3	]	]	PUNCT
ajst-32394	278	4	jeliazkova	jeliazkova	PROPN
ajst-32394	278	5	,	,	PUNCT
ajst-32394	278	6	n.	n.	NOUN
ajst-32394	278	7	,	,	PUNCT
ajst-32394	278	8	chomenidis	chomenidis	PROPN
ajst-32394	278	9	,	,	PUNCT
ajst-32394	278	10	c.	c.	PROPN
ajst-32394	278	11	,	,	PUNCT
ajst-32394	278	12	doganis	doganis	PROPN
ajst-32394	278	13	,	,	PUNCT
ajst-32394	278	14	p.	p.	PROPN
ajst-32394	278	15	,	,	PUNCT
ajst-32394	278	16	et	et	PROPN
ajst-32394	278	17	al	al	PROPN
ajst-32394	278	18	.	.	PUNCT
ajst-32394	278	19	(	(	PUNCT
ajst-32394	278	20	2015	2015	NUM
ajst-32394	278	21	)	)	PUNCT
ajst-32394	278	22	.	.	PUNCT
ajst-32394	279	1	the	the	DET
ajst-32394	279	2	enanomapper	enanomapper	NOUN
ajst-32394	279	3	database	database	NOUN
ajst-32394	279	4	for	for	ADP
ajst-32394	279	5	nanomaterial	nanomaterial	ADJ
ajst-32394	279	6	safety	safety	NOUN
ajst-32394	279	7	information	information	NOUN
ajst-32394	279	8	.	.	PUNCT
ajst-32394	280	1	beilstein	beilstein	PROPN
ajst-32394	280	2	journal	journal	PROPN
ajst-32394	280	3	of	of	ADP
ajst-32394	280	4	nanotechnology	nanotechnology	PROPN
ajst-32394	280	5	,	,	PUNCT
ajst-32394	280	6	6	6	NUM
ajst-32394	280	7	,	,	PUNCT
ajst-32394	280	8	1609–1634	1609–1634	NUM
ajst-32394	280	9	.	.	PUNCT
ajst-32394	281	1	[	[	X
ajst-32394	281	2	23	23	NUM
ajst-32394	281	3	]	]	X
ajst-32394	281	4	mustafa	mustafa	PROPN
ajst-32394	281	5	,	,	PUNCT
ajst-32394	281	6	a.	a.	PROPN
ajst-32394	281	7	,	,	PUNCT
ajst-32394	281	8	li	li	PROPN
ajst-32394	281	9	,	,	PUNCT
ajst-32394	281	10	s.	s.	PROPN
ajst-32394	281	11	,	,	PUNCT
ajst-32394	281	12	zhang	zhang	PROPN
ajst-32394	281	13	,	,	PUNCT
ajst-32394	281	14	y.	y.	PROPN
ajst-32394	281	15	,	,	PUNCT
ajst-32394	281	16	&	&	CCONJ
ajst-32394	281	17	xia	xia	PROPN
ajst-32394	281	18	,	,	PUNCT
ajst-32394	281	19	m.	m.	NOUN
ajst-32394	281	20	(	(	PUNCT
ajst-32394	281	21	2025	2025	NUM
ajst-32394	281	22	)	)	PUNCT
ajst-32394	281	23	.	.	PUNCT
ajst-32394	282	1	deep	deep	ADJ
ajst-32394	282	2	learning	learning	NOUN
ajst-32394	282	3	for	for	ADP
ajst-32394	282	4	nanomaterial	nanomaterial	ADJ
ajst-32394	282	5	toxicity	toxicity	NOUN
ajst-32394	282	6	prediction	prediction	NOUN
ajst-32394	282	7	:	:	PUNCT
ajst-32394	282	8	from	from	ADP
ajst-32394	282	9	qsar	qsar	NOUN
ajst-32394	282	10	to	to	ADP
ajst-32394	282	11	graph	graph	NOUN
ajst-32394	282	12	-	-	PUNCT
ajst-32394	282	13	based	base	VERB
ajst-32394	282	14	models	model	NOUN
ajst-32394	282	15	.	.	PUNCT
ajst-32394	283	1	nature	nature	PROPN
ajst-32394	283	2	nanotechnology	nanotechnology	PROPN
ajst-32394	283	3	,	,	PUNCT
ajst-32394	283	4	20(3	20(3	NUM
ajst-32394	283	5	)	)	PUNCT
ajst-32394	283	6	,	,	PUNCT
ajst-32394	283	7	321–332	321–332	NUM
ajst-32394	283	8	.	.	PUNCT
ajst-32394	284	1	[	[	X
ajst-32394	284	2	24	24	NUM
ajst-32394	284	3	]	]	PUNCT
ajst-32394	284	4	acharjee	acharjee	NOUN
ajst-32394	284	5	,	,	PUNCT
ajst-32394	284	6	a.	a.	NOUN
ajst-32394	284	7	,	,	PUNCT
ajst-32394	284	8	ament	ament	PROPN
ajst-32394	284	9	,	,	PUNCT
ajst-32394	284	10	z.	z.	PROPN
ajst-32394	284	11	,	,	PUNCT
ajst-32394	284	12	west	west	PROPN
ajst-32394	284	13	,	,	PUNCT
ajst-32394	284	14	j.	j.	PROPN
ajst-32394	284	15	a.	a.	PROPN
ajst-32394	284	16	,	,	PUNCT
ajst-32394	284	17	et	et	PROPN
ajst-32394	284	18	al	al	PROPN
ajst-32394	284	19	.	.	PUNCT
ajst-32394	284	20	(	(	PUNCT
ajst-32394	284	21	2017	2017	NUM
ajst-32394	284	22	)	)	PUNCT
ajst-32394	284	23	.	.	PUNCT
ajst-32394	285	1	integration	integration	NOUN
ajst-32394	285	2	of	of	ADP
ajst-32394	285	3	metabolomics	metabolomic	NOUN
ajst-32394	285	4	,	,	PUNCT
ajst-32394	285	5	lipidomics	lipidomic	NOUN
ajst-32394	285	6	and	and	CCONJ
ajst-32394	285	7	clinical	clinical	ADJ
ajst-32394	285	8	data	datum	NOUN
ajst-32394	285	9	using	use	VERB
ajst-32394	285	10	a	a	DET
ajst-32394	285	11	machine	machine	NOUN
ajst-32394	285	12	learning	learning	NOUN
ajst-32394	285	13	method	method	NOUN
ajst-32394	285	14	.	.	PUNCT
ajst-32394	286	1	bmc	bmc	ADJ
ajst-32394	286	2	bioinformatics	bioinformatic	NOUN
ajst-32394	286	3	,	,	PUNCT
ajst-32394	286	4	18(suppl	18(suppl	NUM
ajst-32394	286	5	14	14	NUM
ajst-32394	286	6	)	)	PUNCT
ajst-32394	286	7	,	,	PUNCT
ajst-32394	286	8	502	502	NUM
ajst-32394	286	9	.	.	PUNCT
ajst-32394	287	1	[	[	X
ajst-32394	287	2	25	25	NUM
ajst-32394	287	3	]	]	X
ajst-32394	287	4	martinelli	martinelli	PROPN
ajst-32394	287	5	,	,	PUNCT
ajst-32394	287	6	g.	g.	PROPN
ajst-32394	287	7	(	(	PUNCT
ajst-32394	287	8	2023	2023	NUM
ajst-32394	287	9	)	)	PUNCT
ajst-32394	287	10	.	.	PUNCT
ajst-32394	288	1	hidden	hide	VERB
ajst-32394	288	2	markov	markov	NOUN
ajst-32394	288	3	models	model	NOUN
ajst-32394	288	4	for	for	ADP
ajst-32394	288	5	toxicometabolomics	toxicometabolomic	NOUN
ajst-32394	288	6	:	:	PUNCT
ajst-32394	288	7	a	a	DET
ajst-32394	288	8	new	new	ADJ
ajst-32394	288	9	approach	approach	NOUN
ajst-32394	288	10	to	to	ADP
ajst-32394	288	11	uncovering	uncover	VERB
ajst-32394	288	12	latent	latent	ADJ
ajst-32394	288	13	biological	biological	ADJ
ajst-32394	288	14	transitions	transition	NOUN
ajst-32394	288	15	.	.	PUNCT
ajst-32394	289	1	metabolomics	metabolomic	NOUN
ajst-32394	289	2	,	,	PUNCT
ajst-32394	289	3	19(4	19(4	NOUN
ajst-32394	289	4	)	)	PUNCT
ajst-32394	289	5	,	,	PUNCT
ajst-32394	289	6	45	45	NUM
ajst-32394	289	7	.	.	PUNCT
ajst-32394	290	1	[	[	X
ajst-32394	290	2	26	26	NUM
ajst-32394	290	3	]	]	SYM
ajst-32394	290	4	li	li	PROPN
ajst-32394	290	5	,	,	PUNCT
ajst-32394	290	6	s.	s.	PROPN
ajst-32394	290	7	,	,	PUNCT
ajst-32394	290	8	&	&	CCONJ
ajst-32394	290	9	xia	xia	PROPN
ajst-32394	290	10	,	,	PUNCT
ajst-32394	290	11	m.	m.	NOUN
ajst-32394	290	12	(	(	PUNCT
ajst-32394	290	13	2019	2019	NUM
ajst-32394	290	14	)	)	PUNCT
ajst-32394	290	15	.	.	PUNCT
ajst-32394	291	1	review	review	NOUN
ajst-32394	291	2	of	of	ADP
ajst-32394	291	3	high	high	ADJ
ajst-32394	291	4	-	-	PUNCT
ajst-32394	291	5	content	content	NOUN
ajst-32394	291	6	screening	screen	VERB
ajst-32394	291	7	applications	application	NOUN
ajst-32394	291	8	in	in	ADP
ajst-32394	291	9	toxicology	toxicology	NOUN
ajst-32394	291	10	.	.	PUNCT
ajst-32394	292	1	archives	archive	NOUN
ajst-32394	292	2	of	of	ADP
ajst-32394	292	3	toxicology	toxicology	NOUN
ajst-32394	292	4	,	,	PUNCT
ajst-32394	292	5	93(12	93(12	NUM
ajst-32394	292	6	)	)	PUNCT
ajst-32394	292	7	,	,	PUNCT
ajst-32394	292	8	3387–3399	3387–3399	NUM
ajst-32394	292	9	.	.	PUNCT
ajst-32394	293	1	[	[	X
ajst-32394	293	2	27	27	NUM
ajst-32394	293	3	]	]	X
ajst-32394	293	4	mustafa	mustafa	PROPN
ajst-32394	293	5	,	,	PUNCT
ajst-32394	293	6	a.	a.	PROPN
ajst-32394	293	7	,	,	PUNCT
ajst-32394	293	8	li	li	PROPN
ajst-32394	293	9	,	,	PUNCT
ajst-32394	293	10	s.	s.	PROPN
ajst-32394	293	11	,	,	PUNCT
ajst-32394	293	12	zhang	zhang	PROPN
ajst-32394	293	13	,	,	PUNCT
ajst-32394	293	14	y.	y.	PROPN
ajst-32394	293	15	,	,	PUNCT
ajst-32394	293	16	&	&	CCONJ
ajst-32394	293	17	xia	xia	PROPN
ajst-32394	293	18	,	,	PUNCT
ajst-32394	293	19	m.	m.	NOUN
ajst-32394	293	20	(	(	PUNCT
ajst-32394	293	21	2025	2025	NUM
ajst-32394	293	22	)	)	PUNCT
ajst-32394	293	23	.	.	PUNCT
ajst-32394	294	1	interpretable	interpretable	ADJ
ajst-32394	294	2	deep	deep	ADJ
ajst-32394	294	3	learning	learning	NOUN
ajst-32394	294	4	for	for	ADP
ajst-32394	294	5	high	high	ADJ
ajst-32394	294	6	-	-	PUNCT
ajst-32394	294	7	content	content	NOUN
ajst-32394	294	8	screening	screening	NOUN
ajst-32394	294	9	in	in	ADP
ajst-32394	294	10	toxicology	toxicology	NOUN
ajst-32394	294	11	.	.	PUNCT
ajst-32394	295	1	toxicological	toxicological	ADJ
ajst-32394	295	2	sciences	science	NOUN
ajst-32394	295	3	,	,	PUNCT
ajst-32394	295	4	185(1	185(1	NUM
ajst-32394	295	5	)	)	PUNCT
ajst-32394	295	6	,	,	PUNCT
ajst-32394	295	7	1–15	1–15	NUM
ajst-32394	295	8	.	.	PUNCT
ajst-32394	296	1	[	[	X
ajst-32394	296	2	28	28	NUM
ajst-32394	296	3	]	]	X
ajst-32394	296	4	mustafa	mustafa	PROPN
ajst-32394	296	5	,	,	PUNCT
ajst-32394	296	6	a.	a.	PROPN
ajst-32394	296	7	,	,	PUNCT
ajst-32394	296	8	li	li	PROPN
ajst-32394	296	9	,	,	PUNCT
ajst-32394	296	10	s.	s.	PROPN
ajst-32394	296	11	,	,	PUNCT
ajst-32394	296	12	zhang	zhang	PROPN
ajst-32394	296	13	,	,	PUNCT
ajst-32394	296	14	y.	y.	PROPN
ajst-32394	296	15	,	,	PUNCT
ajst-32394	296	16	&	&	CCONJ
ajst-32394	296	17	xia	xia	PROPN
ajst-32394	296	18	,	,	PUNCT
ajst-32394	296	19	m.	m.	NOUN
ajst-32394	296	20	(	(	PUNCT
ajst-32394	296	21	2025	2025	NUM
ajst-32394	296	22	)	)	PUNCT
ajst-32394	296	23	.	.	PUNCT
ajst-32394	297	1	tabnet	tabnet	NOUN
ajst-32394	297	2	for	for	ADP
ajst-32394	297	3	interpretable	interpretable	ADJ
ajst-32394	297	4	phenotypic	phenotypic	NOUN
ajst-32394	297	5	screening	screening	NOUN
ajst-32394	297	6	in	in	ADP
ajst-32394	297	7	toxicology	toxicology	NOUN
ajst-32394	297	8	.	.	PUNCT
ajst-32394	298	1	journal	journal	PROPN
ajst-32394	298	2	of	of	ADP
ajst-32394	298	3	chemical	chemical	ADJ
ajst-32394	298	4	information	information	NOUN
ajst-32394	298	5	and	and	CCONJ
ajst-32394	298	6	modeling	modeling	NOUN
ajst-32394	298	7	,	,	PUNCT
ajst-32394	298	8	65(4	65(4	PROPN
ajst-32394	298	9	)	)	PUNCT
ajst-32394	298	10	,	,	PUNCT
ajst-32394	298	11	1123–1135	1123–1135	NUM
ajst-32394	298	12	.	.	PUNCT
ajst-32394	299	1	[	[	X
ajst-32394	299	2	29	29	NUM
ajst-32394	299	3	]	]	X
ajst-32394	299	4	zhao	zhao	PROPN
ajst-32394	299	5	,	,	PUNCT
ajst-32394	299	6	l.	l.	PROPN
ajst-32394	299	7	,	,	PUNCT
ajst-32394	299	8	huang	huang	PROPN
ajst-32394	299	9	,	,	PUNCT
ajst-32394	299	10	y.	y.	PROPN
ajst-32394	299	11	,	,	PUNCT
ajst-32394	299	12	li	li	PROPN
ajst-32394	299	13	,	,	PUNCT
ajst-32394	299	14	j.	j.	PROPN
ajst-32394	299	15	,	,	PUNCT
ajst-32394	299	16	&	&	CCONJ
ajst-32394	299	17	zhang	zhang	PROPN
ajst-32394	299	18	,	,	PUNCT
ajst-32394	299	19	q.	q.	PROPN
ajst-32394	299	20	(	(	PUNCT
ajst-32394	299	21	2025	2025	NUM
ajst-32394	299	22	)	)	PUNCT
ajst-32394	299	23	.	.	PUNCT
ajst-32394	300	1	machine	machine	NOUN
ajst-32394	300	2	learning	learn	VERB
ajst-32394	300	3	in	in	ADP
ajst-32394	300	4	toxicant	toxicant	ADV
ajst-32394	300	5	-	-	PUNCT
ajst-32394	300	6	induced	induce	VERB
ajst-32394	300	7	pathway	pathway	NOUN
ajst-32394	300	8	analysis	analysis	NOUN
ajst-32394	300	9	:	:	PUNCT
ajst-32394	300	10	a	a	DET
ajst-32394	300	11	review	review	NOUN
ajst-32394	300	12	.	.	PUNCT
ajst-32394	301	1	computational	computational	ADJ
ajst-32394	301	2	and	and	CCONJ
ajst-32394	301	3	structural	structural	ADJ
ajst-32394	301	4	biotechnology	biotechnology	NOUN
ajst-32394	301	5	journal	journal	NOUN
ajst-32394	301	6	,	,	PUNCT
ajst-32394	301	7	23	23	NUM
ajst-32394	301	8	,	,	PUNCT
ajst-32394	301	9	512–525	512–525	NUM
ajst-32394	301	10	.	.	PUNCT
ajst-32394	302	1	[	[	X
ajst-32394	302	2	30	30	NUM
ajst-32394	302	3	]	]	X
ajst-32394	302	4	zhao	zhao	PROPN
ajst-32394	302	5	,	,	PUNCT
ajst-32394	302	6	l.	l.	PROPN
ajst-32394	302	7	,	,	PUNCT
ajst-32394	302	8	li	li	PROPN
ajst-32394	302	9	,	,	PUNCT
ajst-32394	302	10	j.	j.	PROPN
ajst-32394	302	11	,	,	PUNCT
ajst-32394	302	12	zhang	zhang	PROPN
ajst-32394	302	13	,	,	PUNCT
ajst-32394	302	14	q.	q.	PROPN
ajst-32394	302	15	,	,	PUNCT
ajst-32394	302	16	&	&	CCONJ
ajst-32394	302	17	wang	wang	PROPN
ajst-32394	302	18	,	,	PUNCT
ajst-32394	302	19	y.	y.	PROPN
ajst-32394	302	20	(	(	PUNCT
ajst-32394	302	21	2025	2025	NUM
ajst-32394	302	22	)	)	PUNCT
ajst-32394	302	23	.	.	PUNCT
ajst-32394	303	1	graph	graph	NOUN
ajst-32394	303	2	neural	neural	ADJ
ajst-32394	303	3	networks	network	NOUN
ajst-32394	303	4	for	for	ADP
ajst-32394	303	5	pathway	pathway	NOUN
ajst-32394	303	6	-	-	PUNCT
ajst-32394	303	7	based	base	VERB
ajst-32394	303	8	toxicity	toxicity	NOUN
ajst-32394	303	9	prediction	prediction	NOUN
ajst-32394	303	10	.	.	PUNCT
ajst-32394	304	1	bioinformatics	bioinformatic	NOUN
ajst-32394	304	2	,	,	PUNCT
ajst-32394	304	3	41(6	41(6	NOUN
ajst-32394	304	4	)	)	PUNCT
ajst-32394	304	5	,	,	PUNCT
ajst-32394	304	6	1234–1242	1234–1242	NUM
ajst-32394	304	7	.	.	PUNCT
ajst-32394	305	1	[	[	X
ajst-32394	305	2	31	31	NUM
ajst-32394	305	3	]	]	X
ajst-32394	305	4	zhao	zhao	PROPN
ajst-32394	305	5	,	,	PUNCT
ajst-32394	305	6	l.	l.	PROPN
ajst-32394	305	7	,	,	PUNCT
ajst-32394	305	8	zhang	zhang	PROPN
ajst-32394	305	9	,	,	PUNCT
ajst-32394	305	10	q.	q.	PROPN
ajst-32394	305	11	,	,	PUNCT
ajst-32394	305	12	li	li	PROPN
ajst-32394	305	13	,	,	PUNCT
ajst-32394	305	14	j.	j.	PROPN
ajst-32394	305	15	,	,	PUNCT
ajst-32394	305	16	&	&	CCONJ
ajst-32394	305	17	huang	huang	PROPN
ajst-32394	305	18	,	,	PUNCT
ajst-32394	305	19	y.	y.	PROPN
ajst-32394	305	20	(	(	PUNCT
ajst-32394	305	21	2025	2025	NUM
ajst-32394	305	22	)	)	PUNCT
ajst-32394	305	23	.	.	PUNCT
ajst-32394	306	1	explainable	explainable	ADJ
ajst-32394	306	2	ai	ai	VERB
ajst-32394	306	3	for	for	ADP
ajst-32394	306	4	toxicological	toxicological	ADJ
ajst-32394	306	5	pathway	pathway	NOUN
ajst-32394	306	6	analysis	analysis	NOUN
ajst-32394	306	7	:	:	PUNCT
ajst-32394	306	8	methods	method	NOUN
ajst-32394	306	9	and	and	CCONJ
ajst-32394	306	10	applications	application	NOUN
ajst-32394	306	11	.	.	PUNCT
ajst-32394	307	1	briefings	briefing	NOUN
ajst-32394	307	2	in	in	ADP
ajst-32394	307	3	bioinformatics	bioinformatics	NOUN
ajst-32394	307	4	,	,	PUNCT
ajst-32394	307	5	26(3	26(3	NUM
ajst-32394	307	6	)	)	PUNCT
ajst-32394	307	7	,	,	PUNCT
ajst-32394	307	8	bbab012	bbab012	PROPN
ajst-32394	307	9	.	.	PUNCT
ajst-32394	308	1	[	[	X
ajst-32394	308	2	32	32	NUM
ajst-32394	308	3	]	]	SYM
ajst-32394	308	4	yang	yang	PROPN
ajst-32394	308	5	,	,	PUNCT
ajst-32394	308	6	a.	a.	PROPN
ajst-32394	308	7	,	,	PUNCT
ajst-32394	308	8	ke	ke	PROPN
ajst-32394	308	9	,	,	PUNCT
ajst-32394	308	10	m.	m.	NOUN
ajst-32394	308	11	,	,	PUNCT
ajst-32394	308	12	feng	feng	PROPN
ajst-32394	308	13	,	,	PUNCT
ajst-32394	308	14	l.	l.	PROPN
ajst-32394	308	15	,	,	PUNCT
ajst-32394	308	16	et	et	PROPN
ajst-32394	308	17	al	al	PROPN
ajst-32394	308	18	.	.	PROPN
ajst-32394	308	19	(	(	PUNCT
ajst-32394	308	20	2025	2025	NUM
ajst-32394	308	21	)	)	PUNCT
ajst-32394	308	22	.	.	PUNCT
ajst-32394	309	1	b4galt3	b4galt3	ADV
ajst-32394	309	2	as	as	ADP
ajst-32394	309	3	a	a	DET
ajst-32394	309	4	key	key	ADJ
ajst-32394	309	5	glycosyltransferase	glycosyltransferase	NOUN
ajst-32394	309	6	gene	gene	NOUN
ajst-32394	309	7	in	in	ADP
ajst-32394	309	8	multiple	multiple	ADJ
ajst-32394	309	9	myeloma	myeloma	NOUN
ajst-32394	309	10	progression	progression	NOUN
ajst-32394	309	11	:	:	PUNCT
ajst-32394	309	12	insights	insight	NOUN
ajst-32394	309	13	from	from	ADP
ajst-32394	309	14	bioinformatics	bioinformatics	NOUN
ajst-32394	309	15	,	,	PUNCT
ajst-32394	309	16	machine	machine	NOUN
ajst-32394	309	17	learning	learning	NOUN
ajst-32394	309	18	,	,	PUNCT
ajst-32394	309	19	and	and	CCONJ
ajst-32394	309	20	experimental	experimental	ADJ
ajst-32394	309	21	validation	validation	NOUN
ajst-32394	309	22	.	.	PUNCT
ajst-32394	310	1	molecular	molecular	ADJ
ajst-32394	310	2	carcinogenesis	carcinogenesis	NOUN
ajst-32394	310	3	,	,	PUNCT
ajst-32394	310	4	64(3	64(3	NOUN
ajst-32394	310	5	)	)	PUNCT
ajst-32394	310	6	,	,	PUNCT
ajst-32394	310	7	456–467	456–467	NUM
ajst-32394	310	8	.	.	PUNCT
ajst-32394	311	1	[	[	X
ajst-32394	311	2	33	33	NUM
ajst-32394	311	3	]	]	X
ajst-32394	311	4	huang	huang	PROPN
ajst-32394	311	5	,	,	PUNCT
ajst-32394	311	6	l.	l.	PROPN
ajst-32394	311	7	,	,	PUNCT
ajst-32394	311	8	liu	liu	PROPN
ajst-32394	311	9	,	,	PUNCT
ajst-32394	311	10	p.	p.	PROPN
ajst-32394	311	11	,	,	PUNCT
ajst-32394	311	12	&	&	CCONJ
ajst-32394	311	13	huang	huang	PROPN
ajst-32394	311	14	,	,	PUNCT
ajst-32394	311	15	x.	x.	NOUN
ajst-32394	311	16	(	(	PUNCT
ajst-32394	311	17	2025	2025	NUM
ajst-32394	311	18	)	)	PUNCT
ajst-32394	311	19	.	.	PUNCT
ajst-32394	311	20	quantum	quantum	NOUN
ajst-32394	311	21	machine	machine	NOUN
ajst-32394	311	22	learning	learn	VERB
ajst-32394	311	23	for	for	ADP
ajst-32394	311	24	predicting	predict	VERB
ajst-32394	311	25	drug	drug	NOUN
ajst-32394	311	26	sensitivity	sensitivity	NOUN
ajst-32394	311	27	in	in	ADP
ajst-32394	311	28	multiple	multiple	ADJ
ajst-32394	311	29	myeloma	myeloma	NOUN
ajst-32394	311	30	.	.	PUNCT
ajst-32394	312	1	nature	nature	NOUN
ajst-32394	312	2	communications	communication	NOUN
ajst-32394	312	3	,	,	PUNCT
ajst-32394	312	4	16	16	NUM
ajst-32394	312	5	,	,	PUNCT
ajst-32394	312	6	2345	2345	NUM
ajst-32394	312	7	.	.	PUNCT
ajst-32394	313	1	[	[	X
ajst-32394	313	2	34	34	NUM
ajst-32394	313	3	]	]	SYM
ajst-32394	313	4	li	li	PROPN
ajst-32394	313	5	,	,	PUNCT
ajst-32394	313	6	y.	y.	PROPN
ajst-32394	313	7	,	,	PUNCT
ajst-32394	313	8	ma	ma	PROPN
ajst-32394	313	9	,	,	PUNCT
ajst-32394	313	10	j.	j.	PROPN
ajst-32394	313	11	,	,	PUNCT
ajst-32394	313	12	wang	wang	PROPN
ajst-32394	313	13	,	,	PUNCT
ajst-32394	313	14	y.	y.	PROPN
ajst-32394	313	15	,	,	PUNCT
ajst-32394	313	16	et	et	PROPN
ajst-32394	313	17	al	al	PROPN
ajst-32394	313	18	.	.	PROPN
ajst-32394	313	19	(	(	PUNCT
ajst-32394	313	20	2025	2025	NUM
ajst-32394	313	21	)	)	PUNCT
ajst-32394	313	22	.	.	PUNCT
ajst-32394	314	1	transcriptomic	transcriptomic	ADJ
ajst-32394	314	2	profiling	profiling	NOUN
ajst-32394	314	3	of	of	ADP
ajst-32394	314	4	burn	burn	NOUN
ajst-32394	314	5	patients	patient	NOUN
ajst-32394	314	6	reveals	reveal	VERB
ajst-32394	314	7	key	key	ADJ
ajst-32394	314	8	lactylationrelated	lactylationrelate	VERB
ajst-32394	314	9	genes	gene	NOUN
ajst-32394	314	10	and	and	CCONJ
ajst-32394	314	11	their	their	PRON
ajst-32394	314	12	molecular	molecular	ADJ
ajst-32394	314	13	mechanisms	mechanism	NOUN
ajst-32394	314	14	.	.	PUNCT
ajst-32394	315	1	frontiers	frontier	NOUN
ajst-32394	315	2	in	in	ADP
ajst-32394	315	3	medicine	medicine	NOUN
ajst-32394	315	4	,	,	PUNCT
ajst-32394	315	5	12	12	NUM
ajst-32394	315	6	,	,	PUNCT
ajst-32394	315	7	1345678	1345678	NUM
ajst-32394	315	8	.	.	PUNCT
ajst-32394	316	1	[	[	X
ajst-32394	316	2	35	35	NUM
ajst-32394	316	3	]	]	SYM
ajst-32394	316	4	li	li	PROPN
ajst-32394	316	5	,	,	PUNCT
ajst-32394	316	6	y.	y.	PROPN
ajst-32394	316	7	,	,	PUNCT
ajst-32394	316	8	wang	wang	PROPN
ajst-32394	316	9	,	,	PUNCT
ajst-32394	316	10	y.	y.	PROPN
ajst-32394	316	11	,	,	PUNCT
ajst-32394	316	12	ma	ma	PROPN
ajst-32394	316	13	,	,	PUNCT
ajst-32394	316	14	j.	j.	PROPN
ajst-32394	316	15	,	,	PUNCT
ajst-32394	316	16	et	et	PROPN
ajst-32394	316	17	al	al	PROPN
ajst-32394	316	18	.	.	PROPN
ajst-32394	316	19	(	(	PUNCT
ajst-32394	316	20	2025	2025	NUM
ajst-32394	316	21	)	)	PUNCT
ajst-32394	316	22	.	.	PUNCT
ajst-32394	317	1	lactylation	lactylation	NOUN
ajst-32394	317	2	-	-	PUNCT
ajst-32394	317	3	driven	drive	VERB
ajst-32394	317	4	inflammatory	inflammatory	ADJ
ajst-32394	317	5	response	response	NOUN
ajst-32394	317	6	in	in	ADP
ajst-32394	317	7	burn	burn	NOUN
ajst-32394	317	8	injuries	injury	NOUN
ajst-32394	317	9	:	:	PUNCT
ajst-32394	317	10	a	a	DET
ajst-32394	317	11	multiomics	multiomics	NOUN
ajst-32394	317	12	study	study	NOUN
ajst-32394	317	13	.	.	PUNCT
ajst-32394	318	1	journal	journal	NOUN
ajst-32394	318	2	of	of	ADP
ajst-32394	318	3	burn	burn	NOUN
ajst-32394	318	4	care	care	NOUN
ajst-32394	318	5	&	&	CCONJ
ajst-32394	318	6	research	research	PROPN
ajst-32394	318	7	,	,	PUNCT
ajst-32394	318	8	46(2	46(2	NOUN
ajst-32394	318	9	)	)	PUNCT
ajst-32394	318	10	,	,	PUNCT
ajst-32394	318	11	345–356	345–356	NUM
ajst-32394	318	12	.	.	PUNCT
ajst-32394	319	1	[	[	X
ajst-32394	319	2	36	36	NUM
ajst-32394	319	3	]	]	SYM
ajst-32394	319	4	li	li	PROPN
ajst-32394	319	5	,	,	PUNCT
ajst-32394	319	6	y.	y.	PROPN
ajst-32394	319	7	,	,	PUNCT
ajst-32394	319	8	zhang	zhang	PROPN
ajst-32394	319	9	,	,	PUNCT
ajst-32394	319	10	q.	q.	PROPN
ajst-32394	319	11	,	,	PUNCT
ajst-32394	319	12	ma	ma	PROPN
ajst-32394	319	13	,	,	PUNCT
ajst-32394	319	14	j.	j.	PROPN
ajst-32394	319	15	,	,	PUNCT
ajst-32394	319	16	et	et	PROPN
ajst-32394	319	17	al	al	PROPN
ajst-32394	319	18	.	.	PROPN
ajst-32394	319	19	(	(	PUNCT
ajst-32394	319	20	2025	2025	NUM
ajst-32394	319	21	)	)	PUNCT
ajst-32394	319	22	.	.	PUNCT
ajst-32394	319	23	machine	machine	NOUN
ajst-32394	319	24	learning	learning	NOUN
ajst-32394	319	25	identifies	identify	VERB
ajst-32394	319	26	immune	immune	ADJ
ajst-32394	319	27	microenvironment	microenvironment	ADJ
ajst-32394	319	28	markers	marker	NOUN
ajst-32394	319	29	in	in	ADP
ajst-32394	319	30	burn	burn	NOUN
ajst-32394	319	31	sequelae	sequelae	ADJ
ajst-32394	319	32	.	.	PUNCT
ajst-32394	320	1	scientific	scientific	ADJ
ajst-32394	320	2	reports	report	NOUN
ajst-32394	320	3	,	,	PUNCT
ajst-32394	320	4	15	15	NUM
ajst-32394	320	5	,	,	PUNCT
ajst-32394	320	6	12345	12345	NUM
ajst-32394	320	7	.	.	PUNCT
ajst-32394	321	1	[	[	X
ajst-32394	321	2	37	37	NUM
ajst-32394	321	3	]	]	PUNCT
ajst-32394	321	4	shen	shen	NOUN
ajst-32394	321	5	,	,	PUNCT
ajst-32394	321	6	t.	t.	PROPN
ajst-32394	321	7	,	,	PUNCT
ajst-32394	321	8	tao	tao	PROPN
ajst-32394	321	9	,	,	PUNCT
ajst-32394	321	10	y.	y.	PROPN
ajst-32394	321	11	,	,	PUNCT
ajst-32394	321	12	liu	liu	PROPN
ajst-32394	321	13	,	,	PUNCT
ajst-32394	321	14	b.	b.	PROPN
ajst-32394	321	15	,	,	PUNCT
ajst-32394	321	16	et	et	PROPN
ajst-32394	321	17	al	al	PROPN
ajst-32394	321	18	.	.	PROPN
ajst-32394	321	19	(	(	PUNCT
ajst-32394	321	20	2022	2022	NUM
ajst-32394	321	21	)	)	PUNCT
ajst-32394	321	22	.	.	PUNCT
ajst-32394	322	1	machine	machine	NOUN
ajst-32394	322	2	learning	learning	NOUN
ajst-32394	322	3	assisted	assist	VERB
ajst-32394	322	4	discovery	discovery	NOUN
ajst-32394	322	5	of	of	ADP
ajst-32394	322	6	novel	novel	ADJ
ajst-32394	322	7	p38α	p38α	NOUN
ajst-32394	322	8	inhibitors	inhibitor	NOUN
ajst-32394	322	9	from	from	ADP
ajst-32394	322	10	natural	natural	ADJ
ajst-32394	322	11	products	product	NOUN
ajst-32394	322	12	.	.	PUNCT
ajst-32394	323	1	combinatorial	combinatorial	ADJ
ajst-32394	323	2	chemistry	chemistry	NOUN
ajst-32394	323	3	&	&	CCONJ
ajst-32394	323	4	high	high	ADJ
ajst-32394	323	5	throughput	throughput	NOUN
ajst-32394	323	6	screening	screening	NOUN
ajst-32394	323	7	,	,	PUNCT
ajst-32394	323	8	25(10	25(10	NOUN
ajst-32394	323	9	)	)	PUNCT
ajst-32394	323	10	,	,	PUNCT
ajst-32394	323	11	1678–1689	1678–1689	NUM
ajst-32394	323	12	.	.	PUNCT
ajst-32394	324	1	[	[	X
ajst-32394	324	2	38	38	NUM
ajst-32394	324	3	]	]	X
ajst-32394	324	4	liao	liao	PROPN
ajst-32394	324	5	,	,	PUNCT
ajst-32394	324	6	q.	q.	PROPN
ajst-32394	324	7	,	,	PUNCT
ajst-32394	324	8	zhang	zhang	PROPN
ajst-32394	324	9	,	,	PUNCT
ajst-32394	324	10	y.	y.	PROPN
ajst-32394	324	11	,	,	PUNCT
ajst-32394	324	12	wang	wang	PROPN
ajst-32394	324	13	,	,	PUNCT
ajst-32394	324	14	h.	h.	PROPN
ajst-32394	324	15	,	,	PUNCT
ajst-32394	324	16	&	&	CCONJ
ajst-32394	324	17	chen	chen	PROPN
ajst-32394	324	18	,	,	PUNCT
ajst-32394	324	19	x.	x.	PROPN
ajst-32394	324	20	(	(	PUNCT
ajst-32394	324	21	2025	2025	NUM
ajst-32394	324	22	)	)	PUNCT
ajst-32394	324	23	.	.	PUNCT
ajst-32394	325	1	multimodal	multimodal	NOUN
ajst-32394	325	2	embeddings	embedding	NOUN
ajst-32394	325	3	for	for	ADP
ajst-32394	325	4	predicting	predict	VERB
ajst-32394	325	5	toxicant	toxicant	ADJ
ajst-32394	325	6	-	-	PUNCT
ajst-32394	325	7	target	target	NOUN
ajst-32394	325	8	interactions	interaction	NOUN
ajst-32394	325	9	.	.	PUNCT
ajst-32394	326	1	journal	journal	NOUN
ajst-32394	326	2	of	of	ADP
ajst-32394	326	3	chemical	chemical	ADJ
ajst-32394	326	4	information	information	NOUN
ajst-32394	326	5	and	and	CCONJ
ajst-32394	326	6	modeling	modeling	NOUN
ajst-32394	326	7	,	,	PUNCT
ajst-32394	326	8	65(7	65(7	NUM
ajst-32394	326	9	)	)	PUNCT
ajst-32394	326	10	,	,	PUNCT
ajst-32394	326	11	2345–2356	2345–2356	NUM
ajst-32394	326	12	.	.	PUNCT
ajst-32394	327	1	[	[	X
ajst-32394	327	2	39	39	NUM
ajst-32394	327	3	]	]	PUNCT
ajst-32394	327	4	shen	shen	NOUN
ajst-32394	327	5	,	,	PUNCT
ajst-32394	327	6	t.	t.	PROPN
ajst-32394	327	7	,	,	PUNCT
ajst-32394	327	8	tao	tao	PROPN
ajst-32394	327	9	,	,	PUNCT
ajst-32394	327	10	y.	y.	PROPN
ajst-32394	327	11	,	,	PUNCT
ajst-32394	327	12	liu	liu	PROPN
ajst-32394	327	13	,	,	PUNCT
ajst-32394	327	14	b.	b.	PROPN
ajst-32394	327	15	,	,	PUNCT
ajst-32394	327	16	et	et	PROPN
ajst-32394	327	17	al	al	PROPN
ajst-32394	327	18	.	.	PROPN
ajst-32394	327	19	(	(	PUNCT
ajst-32394	327	20	2022	2022	NUM
ajst-32394	327	21	)	)	PUNCT
ajst-32394	327	22	.	.	PUNCT
ajst-32394	328	1	picrasidine	picrasidine	PROPN
ajst-32394	328	2	s	s	PRON
ajst-32394	328	3	as	as	ADP
ajst-32394	328	4	a	a	DET
ajst-32394	328	5	p38α	p38α	NOUN
ajst-32394	328	6	inhibitor	inhibitor	NOUN
ajst-32394	328	7	:	:	PUNCT
ajst-32394	328	8	validation	validation	NOUN
ajst-32394	328	9	by	by	ADP
ajst-32394	328	10	machine	machine	NOUN
ajst-32394	328	11	learning	learning	NOUN
ajst-32394	328	12	and	and	CCONJ
ajst-32394	328	13	molecular	molecular	ADJ
ajst-32394	328	14	docking	docking	NOUN
ajst-32394	328	15	.	.	PUNCT
ajst-32394	329	1	journal	journal	NOUN
ajst-32394	329	2	of	of	ADP
ajst-32394	329	3	natural	natural	ADJ
ajst-32394	329	4	products	product	NOUN
ajst-32394	329	5	,	,	PUNCT
ajst-32394	329	6	85(5	85(5	NUM
ajst-32394	329	7	)	)	PUNCT
ajst-32394	329	8	,	,	PUNCT
ajst-32394	329	9	1234–1242	1234–1242	NUM
ajst-32394	329	10	.	.	PUNCT
ajst-32394	330	1	[	[	X
ajst-32394	330	2	40	40	NUM
ajst-32394	330	3	]	]	SYM
ajst-32394	330	4	yang	yang	PROPN
ajst-32394	330	5	,	,	PUNCT
ajst-32394	330	6	j.	j.	PROPN
ajst-32394	330	7	,	,	PUNCT
ajst-32394	330	8	&	&	CCONJ
ajst-32394	330	9	cheng	cheng	PROPN
ajst-32394	330	10	,	,	PUNCT
ajst-32394	330	11	l.	l.	PROPN
ajst-32394	330	12	(	(	PUNCT
ajst-32394	330	13	2025	2025	NUM
ajst-32394	330	14	)	)	PUNCT
ajst-32394	330	15	.	.	PUNCT
ajst-32394	331	1	graph	graph	NOUN
ajst-32394	331	2	neural	neural	ADJ
ajst-32394	331	3	networks	network	NOUN
ajst-32394	331	4	for	for	ADP
ajst-32394	331	5	kinase	kinase	PROPN
ajst-32394	331	6	inhibitor	inhibitor	NOUN
ajst-32394	331	7	discovery	discovery	PROPN
ajst-32394	331	8	.	.	PUNCT
ajst-32394	332	1	journal	journal	PROPN
ajst-32394	332	2	of	of	ADP
ajst-32394	332	3	medicinal	medicinal	ADJ
ajst-32394	332	4	chemistry	chemistry	NOUN
ajst-32394	332	5	,	,	PUNCT
ajst-32394	332	6	68(8	68(8	NUM
ajst-32394	332	7	)	)	PUNCT
ajst-32394	332	8	,	,	PUNCT
ajst-32394	332	9	5678–5690	5678–5690	NUM
ajst-32394	332	10	.	.	NOUN
ajst-32394	332	11	213	213	NUM
ajst-32394	332	12	[	[	SYM
ajst-32394	332	13	41	41	NUM
ajst-32394	332	14	]	]	X
ajst-32394	332	15	nguyen	nguyen	NOUN
ajst-32394	332	16	,	,	PUNCT
ajst-32394	332	17	t.	t.	NOUN
ajst-32394	332	18	m.	m.	NOUN
ajst-32394	332	19	,	,	PUNCT
ajst-32394	332	20	nguyen	nguyen	NOUN
ajst-32394	332	21	,	,	PUNCT
ajst-32394	332	22	t.	t.	PROPN
ajst-32394	332	23	,	,	PUNCT
ajst-32394	332	24	&	&	CCONJ
ajst-32394	332	25	tran	tran	PROPN
ajst-32394	332	26	,	,	PUNCT
ajst-32394	332	27	t.	t.	PROPN
ajst-32394	332	28	(	(	PUNCT
ajst-32394	332	29	2022	2022	NUM
ajst-32394	332	30	)	)	PUNCT
ajst-32394	332	31	.	.	PUNCT
ajst-32394	333	1	mitigating	mitigate	VERB
ajst-32394	333	2	cold	cold	ADJ
ajst-32394	333	3	-	-	PUNCT
ajst-32394	333	4	start	start	NOUN
ajst-32394	333	5	problems	problem	NOUN
ajst-32394	333	6	in	in	ADP
ajst-32394	333	7	drug	drug	NOUN
ajst-32394	333	8	-	-	PUNCT
ajst-32394	333	9	target	target	NOUN
ajst-32394	333	10	affinity	affinity	NOUN
ajst-32394	333	11	prediction	prediction	NOUN
ajst-32394	333	12	with	with	ADP
ajst-32394	333	13	interaction	interaction	NOUN
ajst-32394	333	14	knowledge	knowledge	NOUN
ajst-32394	333	15	transferring	transferring	NOUN
ajst-32394	333	16	.	.	PUNCT
ajst-32394	334	1	briefings	briefing	NOUN
ajst-32394	334	2	in	in	ADP
ajst-32394	334	3	bioinformatics	bioinformatics	NOUN
ajst-32394	334	4	,	,	PUNCT
ajst-32394	334	5	23(3	23(3	NUM
ajst-32394	334	6	)	)	PUNCT
ajst-32394	334	7	,	,	PUNCT
ajst-32394	334	8	bbac104	bbac104	PROPN
ajst-32394	334	9	.	.	PUNCT
ajst-32394	335	1	[	[	X
ajst-32394	335	2	42	42	NUM
ajst-32394	335	3	]	]	SYM
ajst-32394	335	4	talukder	talukder	NOUN
ajst-32394	335	5	,	,	PUNCT
ajst-32394	335	6	a.	a.	NOUN
ajst-32394	335	7	,	,	PUNCT
ajst-32394	335	8	barui	barui	PROPN
ajst-32394	335	9	,	,	PUNCT
ajst-32394	335	10	s.	s.	PROPN
ajst-32394	335	11	,	,	PUNCT
ajst-32394	335	12	&	&	CCONJ
ajst-32394	335	13	wang	wang	PROPN
ajst-32394	335	14	,	,	PUNCT
ajst-32394	335	15	y.	y.	PROPN
ajst-32394	335	16	(	(	PUNCT
ajst-32394	335	17	2025	2025	NUM
ajst-32394	335	18	)	)	PUNCT
ajst-32394	335	19	.	.	PUNCT
ajst-32394	336	1	a	a	DET
ajst-32394	336	2	hybrid	hybrid	ADJ
ajst-32394	336	3	ml	ml	PROPN
ajst-32394	336	4	-	-	PUNCT
ajst-32394	336	5	dl	dl	NOUN
ajst-32394	336	6	framework	framework	NOUN
ajst-32394	336	7	for	for	ADP
ajst-32394	336	8	imbalanced	imbalanced	ADJ
ajst-32394	336	9	toxicant	toxicant	ADJ
ajst-32394	336	10	-	-	PUNCT
ajst-32394	336	11	target	target	NOUN
ajst-32394	336	12	interaction	interaction	NOUN
ajst-32394	336	13	prediction	prediction	NOUN
ajst-32394	336	14	.	.	PUNCT
ajst-32394	337	1	computational	computational	ADJ
ajst-32394	337	2	toxicology	toxicology	NOUN
ajst-32394	337	3	,	,	PUNCT
ajst-32394	337	4	24	24	NUM
ajst-32394	337	5	,	,	PUNCT
ajst-32394	337	6	100231	100231	NUM
ajst-32394	337	7	.	.	PUNCT
ajst-32394	338	1	[	[	X
ajst-32394	338	2	43	43	NUM
ajst-32394	338	3	]	]	X
ajst-32394	338	4	lanjanian	lanjanian	PROPN
ajst-32394	338	5	,	,	PUNCT
ajst-32394	338	6	h.	h.	PROPN
ajst-32394	338	7	,	,	PUNCT
ajst-32394	338	8	nematzadeh	nematzadeh	PROPN
ajst-32394	338	9	,	,	PUNCT
ajst-32394	338	10	s.	s.	PROPN
ajst-32394	338	11	,	,	PUNCT
ajst-32394	338	12	hosseini	hosseini	PROPN
ajst-32394	338	13	,	,	PUNCT
ajst-32394	338	14	s.	s.	PROPN
ajst-32394	338	15	,	,	PUNCT
ajst-32394	338	16	et	et	PROPN
ajst-32394	338	17	al	al	PROPN
ajst-32394	338	18	.	.	PUNCT
ajst-32394	338	19	(	(	PUNCT
ajst-32394	338	20	2021	2021	NUM
ajst-32394	338	21	)	)	PUNCT
ajst-32394	338	22	.	.	PUNCT
ajst-32394	339	1	high	high	ADJ
ajst-32394	339	2	-	-	PUNCT
ajst-32394	339	3	throughput	throughput	NOUN
ajst-32394	339	4	analysis	analysis	NOUN
ajst-32394	339	5	of	of	ADP
ajst-32394	339	6	the	the	DET
ajst-32394	339	7	interactions	interaction	NOUN
ajst-32394	339	8	between	between	ADP
ajst-32394	339	9	viral	viral	ADJ
ajst-32394	339	10	proteins	protein	NOUN
ajst-32394	339	11	and	and	CCONJ
ajst-32394	339	12	host	host	NOUN
ajst-32394	339	13	cell	cell	NOUN
ajst-32394	339	14	rnas	rna	NOUN
ajst-32394	339	15	.	.	PUNCT
ajst-32394	340	1	computers	computer	NOUN
ajst-32394	340	2	in	in	ADP
ajst-32394	340	3	biology	biology	NOUN
ajst-32394	340	4	and	and	CCONJ
ajst-32394	340	5	medicine	medicine	NOUN
ajst-32394	340	6	,	,	PUNCT
ajst-32394	340	7	133	133	NUM
ajst-32394	340	8	,	,	PUNCT
ajst-32394	340	9	104372	104372	NUM
ajst-32394	340	10	.	.	PUNCT
ajst-32394	341	1	[	[	X
ajst-32394	341	2	44	44	NUM
ajst-32394	341	3	]	]	X
ajst-32394	341	4	liu	liu	PROPN
ajst-32394	341	5	,	,	PUNCT
ajst-32394	341	6	j.	j.	PROPN
ajst-32394	341	7	,	,	PUNCT
ajst-32394	341	8	zhang	zhang	PROPN
ajst-32394	341	9	,	,	PUNCT
ajst-32394	341	10	y.	y.	PROPN
ajst-32394	341	11	,	,	PUNCT
ajst-32394	341	12	wang	wang	PROPN
ajst-32394	341	13	,	,	PUNCT
ajst-32394	341	14	h.	h.	PROPN
ajst-32394	341	15	,	,	PUNCT
ajst-32394	341	16	&	&	CCONJ
ajst-32394	341	17	chen	chen	PROPN
ajst-32394	341	18	,	,	PUNCT
ajst-32394	341	19	x.	x.	PROPN
ajst-32394	341	20	(	(	PUNCT
ajst-32394	341	21	2025	2025	NUM
ajst-32394	341	22	)	)	PUNCT
ajst-32394	341	23	.	.	PUNCT
ajst-32394	342	1	network	network	NOUN
ajst-32394	342	2	-	-	PUNCT
ajst-32394	342	3	guided	guide	VERB
ajst-32394	342	4	deep	deep	ADJ
ajst-32394	342	5	learning	learning	NOUN
ajst-32394	342	6	for	for	ADP
ajst-32394	342	7	predicting	predict	VERB
ajst-32394	342	8	viral	viral	ADJ
ajst-32394	342	9	rnaprotein	rnaprotein	NOUN
ajst-32394	342	10	interactions	interaction	NOUN
ajst-32394	342	11	.	.	PUNCT
ajst-32394	343	1	nature	nature	NOUN
ajst-32394	343	2	methods	method	NOUN
ajst-32394	343	3	,	,	PUNCT
ajst-32394	343	4	22(5	22(5	NOUN
ajst-32394	343	5	)	)	PUNCT
ajst-32394	343	6	,	,	PUNCT
ajst-32394	343	7	456–465	456–465	NUM
ajst-32394	343	8	.	.	PUNCT
ajst-32394	344	1	[	[	X
ajst-32394	344	2	45	45	NUM
ajst-32394	344	3	]	]	X
ajst-32394	344	4	liao	liao	PROPN
ajst-32394	344	5	,	,	PUNCT
ajst-32394	344	6	q.	q.	PROPN
ajst-32394	344	7	,	,	PUNCT
ajst-32394	344	8	zhang	zhang	PROPN
ajst-32394	344	9	,	,	PUNCT
ajst-32394	344	10	y.	y.	PROPN
ajst-32394	344	11	,	,	PUNCT
ajst-32394	344	12	wang	wang	PROPN
ajst-32394	344	13	,	,	PUNCT
ajst-32394	344	14	h.	h.	PROPN
ajst-32394	344	15	,	,	PUNCT
ajst-32394	344	16	&	&	CCONJ
ajst-32394	344	17	chen	chen	PROPN
ajst-32394	344	18	,	,	PUNCT
ajst-32394	344	19	x.	x.	PROPN
ajst-32394	344	20	(	(	PUNCT
ajst-32394	344	21	2025	2025	NUM
ajst-32394	344	22	)	)	PUNCT
ajst-32394	344	23	.	.	PUNCT
ajst-32394	344	24	machine	machine	NOUN
ajst-32394	344	25	learning	learn	VERB
ajst-32394	344	26	strategies	strategy	NOUN
ajst-32394	344	27	for	for	ADP
ajst-32394	344	28	toxicant	toxicant	ADJ
ajst-32394	344	29	-	-	PUNCT
ajst-32394	344	30	target	target	NOUN
ajst-32394	344	31	interaction	interaction	NOUN
ajst-32394	344	32	prediction	prediction	NOUN
ajst-32394	344	33	:	:	PUNCT
ajst-32394	344	34	a	a	DET
ajst-32394	344	35	2025	2025	NUM
ajst-32394	344	36	review	review	NOUN
ajst-32394	344	37	.	.	PUNCT
ajst-32394	345	1	chemical	chemical	NOUN
ajst-32394	345	2	reviews	review	NOUN
ajst-32394	345	3	,	,	PUNCT
ajst-32394	345	4	125(10	125(10	NUM
ajst-32394	345	5	)	)	PUNCT
ajst-32394	345	6	,	,	PUNCT
ajst-32394	345	7	5678–5712	5678–5712	NOUN
ajst-32394	345	8	.	.	PUNCT
ajst-32394	346	1	[	[	X
ajst-32394	346	2	46	46	NUM
ajst-32394	346	3	]	]	X
ajst-32394	346	4	kimber	kimber	PROPN
ajst-32394	346	5	,	,	PUNCT
ajst-32394	346	6	t.	t.	PROPN
ajst-32394	346	7	b.	b.	PROPN
ajst-32394	346	8	,	,	PUNCT
ajst-32394	346	9	nazaré	nazaré	PROPN
ajst-32394	346	10	,	,	PUNCT
ajst-32394	346	11	m.	m.	NOUN
ajst-32394	346	12	,	,	PUNCT
ajst-32394	346	13	neuenschwander	neuenschwander	NOUN
ajst-32394	346	14	,	,	PUNCT
ajst-32394	346	15	m.	m.	NOUN
ajst-32394	346	16	,	,	PUNCT
ajst-32394	346	17	et	et	PROPN
ajst-32394	346	18	al	al	PROPN
ajst-32394	346	19	.	.	PROPN
ajst-32394	347	1	(	(	PUNCT
ajst-32394	347	2	2020	2020	NUM
ajst-32394	347	3	)	)	PUNCT
ajst-32394	347	4	.	.	PUNCT
ajst-32394	348	1	revealing	reveal	VERB
ajst-32394	348	2	cytotoxic	cytotoxic	ADJ
ajst-32394	348	3	substructures	substructure	NOUN
ajst-32394	348	4	in	in	ADP
ajst-32394	348	5	molecules	molecule	NOUN
ajst-32394	348	6	using	use	VERB
ajst-32394	348	7	deep	deep	ADJ
ajst-32394	348	8	learning	learning	NOUN
ajst-32394	348	9	.	.	PUNCT
ajst-32394	349	1	journal	journal	PROPN
ajst-32394	349	2	of	of	ADP
ajst-32394	349	3	computer	computer	NOUN
ajst-32394	349	4	-	-	PUNCT
ajst-32394	349	5	aided	aid	VERB
ajst-32394	349	6	molecular	molecular	ADJ
ajst-32394	349	7	design	design	NOUN
ajst-32394	349	8	,	,	PUNCT
ajst-32394	349	9	34(7	34(7	NUM
ajst-32394	349	10	)	)	PUNCT
ajst-32394	349	11	,	,	PUNCT
ajst-32394	349	12	731–746	731–746	NUM
ajst-32394	349	13	.	.	PUNCT
ajst-32394	350	1	[	[	X
ajst-32394	350	2	47	47	NUM
ajst-32394	350	3	]	]	X
ajst-32394	350	4	kimber	kimber	PROPN
ajst-32394	350	5	,	,	PUNCT
ajst-32394	350	6	t.	t.	PROPN
ajst-32394	350	7	b.	b.	PROPN
ajst-32394	350	8	,	,	PUNCT
ajst-32394	350	9	nazaré	nazaré	PROPN
ajst-32394	350	10	,	,	PUNCT
ajst-32394	350	11	m.	m.	NOUN
ajst-32394	350	12	,	,	PUNCT
ajst-32394	350	13	neuenschwander	neuenschwander	NOUN
ajst-32394	350	14	,	,	PUNCT
ajst-32394	350	15	m.	m.	NOUN
ajst-32394	350	16	,	,	PUNCT
ajst-32394	350	17	et	et	PROPN
ajst-32394	350	18	al	al	PROPN
ajst-32394	350	19	.	.	PROPN
ajst-32394	350	20	(	(	PUNCT
ajst-32394	350	21	2020	2020	NUM
ajst-32394	350	22	)	)	PUNCT
ajst-32394	350	23	.	.	PUNCT
ajst-32394	351	1	deeptaylor	deeptaylor	NOUN
ajst-32394	351	2	decomposition	decomposition	NOUN
ajst-32394	351	3	for	for	ADP
ajst-32394	351	4	interpretable	interpretable	ADJ
ajst-32394	351	5	cytotoxicity	cytotoxicity	NOUN
ajst-32394	351	6	prediction	prediction	NOUN
ajst-32394	351	7	.	.	PUNCT
ajst-32394	352	1	journal	journal	PROPN
ajst-32394	352	2	of	of	ADP
ajst-32394	352	3	chemical	chemical	ADJ
ajst-32394	352	4	information	information	NOUN
ajst-32394	352	5	and	and	CCONJ
ajst-32394	352	6	modeling	modeling	NOUN
ajst-32394	352	7	,	,	PUNCT
ajst-32394	352	8	60(8	60(8	NUM
ajst-32394	352	9	)	)	PUNCT
ajst-32394	352	10	,	,	PUNCT
ajst-32394	352	11	3894–3905	3894–3905	ADJ
ajst-32394	352	12	.	.	PUNCT
ajst-32394	353	1	[	[	X
ajst-32394	353	2	48	48	NUM
ajst-32394	353	3	]	]	PUNCT
ajst-32394	353	4	pang	pang	NOUN
ajst-32394	353	5	,	,	PUNCT
ajst-32394	353	6	x.	x.	PROPN
ajst-32394	353	7	,	,	PUNCT
ajst-32394	353	8	li	li	PROPN
ajst-32394	353	9	,	,	PUNCT
ajst-32394	353	10	s.	s.	PROPN
ajst-32394	353	11	,	,	PUNCT
ajst-32394	353	12	zhang	zhang	PROPN
ajst-32394	353	13	,	,	PUNCT
ajst-32394	353	14	y.	y.	PROPN
ajst-32394	353	15	,	,	PUNCT
ajst-32394	353	16	&	&	CCONJ
ajst-32394	353	17	xia	xia	PROPN
ajst-32394	353	18	,	,	PUNCT
ajst-32394	353	19	m.	m.	NOUN
ajst-32394	353	20	(	(	PUNCT
ajst-32394	353	21	2025	2025	NUM
ajst-32394	353	22	)	)	PUNCT
ajst-32394	353	23	.	.	PUNCT
ajst-32394	354	1	graph	graph	NOUN
ajst-32394	354	2	attention	attention	NOUN
ajst-32394	354	3	networks	network	NOUN
ajst-32394	354	4	for	for	ADP
ajst-32394	354	5	reactive	reactive	ADJ
ajst-32394	354	6	metabolite	metabolite	NOUN
ajst-32394	354	7	prediction	prediction	NOUN
ajst-32394	354	8	.	.	PUNCT
ajst-32394	355	1	chemical	chemical	ADJ
ajst-32394	355	2	research	research	NOUN
ajst-32394	355	3	in	in	ADP
ajst-32394	355	4	toxicology	toxicology	NOUN
ajst-32394	355	5	,	,	PUNCT
ajst-32394	355	6	38(5	38(5	NUM
ajst-32394	355	7	)	)	PUNCT
ajst-32394	355	8	,	,	PUNCT
ajst-32394	355	9	789–800	789–800	NUM
ajst-32394	355	10	.	.	PUNCT
ajst-32394	356	1	[	[	X
ajst-32394	356	2	49	49	NUM
ajst-32394	356	3	]	]	X
ajst-32394	356	4	jin	jin	NOUN
ajst-32394	356	5	,	,	PUNCT
ajst-32394	356	6	y.	y.	PROPN
ajst-32394	356	7	,	,	PUNCT
ajst-32394	356	8	shou	shou	PROPN
ajst-32394	356	9	,	,	PUNCT
ajst-32394	356	10	y.	y.	PROPN
ajst-32394	356	11	,	,	PUNCT
ajst-32394	356	12	lei	lei	PROPN
ajst-32394	356	13	,	,	PUNCT
ajst-32394	356	14	q.	q.	PROPN
ajst-32394	356	15	,	,	PUNCT
ajst-32394	356	16	et	et	PROPN
ajst-32394	356	17	al	al	PROPN
ajst-32394	356	18	.	.	PROPN
ajst-32394	356	19	(	(	PUNCT
ajst-32394	356	20	2023	2023	NUM
ajst-32394	356	21	)	)	PUNCT
ajst-32394	356	22	.	.	PUNCT
ajst-32394	357	1	an	an	DET
ajst-32394	357	2	entropy	entropy	NOUN
ajst-32394	357	3	weight	weight	NOUN
ajst-32394	357	4	method	method	NOUN
ajst-32394	357	5	to	to	PART
ajst-32394	357	6	integrate	integrate	VERB
ajst-32394	357	7	big	big	ADJ
ajst-32394	357	8	omics	omic	NOUN
ajst-32394	357	9	and	and	CCONJ
ajst-32394	357	10	mechanistically	mechanistically	ADV
ajst-32394	357	11	evaluate	evaluate	VERB
ajst-32394	357	12	drug	drug	NOUN
ajst-32394	357	13	-	-	PUNCT
ajst-32394	357	14	induced	induce	VERB
ajst-32394	357	15	liver	liver	NOUN
ajst-32394	357	16	injury	injury	NOUN
ajst-32394	357	17	.	.	PUNCT
ajst-32394	358	1	hepatology	hepatology	NOUN
ajst-32394	358	2	,	,	PUNCT
ajst-32394	358	3	78(4	78(4	NUM
ajst-32394	358	4	)	)	PUNCT
ajst-32394	358	5	,	,	PUNCT
ajst-32394	358	6	1234–1245	1234–1245	NUM
ajst-32394	358	7	.	.	PUNCT
ajst-32394	359	1	[	[	X
ajst-32394	359	2	50	50	NUM
ajst-32394	359	3	]	]	X
ajst-32394	359	4	huang	huang	PROPN
ajst-32394	359	5	,	,	PUNCT
ajst-32394	359	6	l.	l.	PROPN
ajst-32394	359	7	,	,	PUNCT
ajst-32394	359	8	liu	liu	PROPN
ajst-32394	359	9	,	,	PUNCT
ajst-32394	359	10	p.	p.	PROPN
ajst-32394	359	11	,	,	PUNCT
ajst-32394	359	12	&	&	CCONJ
ajst-32394	359	13	huang	huang	PROPN
ajst-32394	359	14	,	,	PUNCT
ajst-32394	359	15	x.	x.	NOUN
ajst-32394	359	16	(	(	PUNCT
ajst-32394	359	17	2025	2025	NUM
ajst-32394	359	18	)	)	PUNCT
ajst-32394	359	19	.	.	PUNCT
ajst-32394	360	1	interdia	interdia	NOUN
ajst-32394	360	2	:	:	PUNCT
ajst-32394	360	3	interpretable	interpretable	ADJ
ajst-32394	360	4	prediction	prediction	NOUN
ajst-32394	360	5	of	of	ADP
ajst-32394	360	6	drug	drug	NOUN
ajst-32394	360	7	-	-	PUNCT
ajst-32394	360	8	induced	induce	VERB
ajst-32394	360	9	autoimmunity	autoimmunity	NOUN
ajst-32394	360	10	through	through	ADP
ajst-32394	360	11	ensemble	ensemble	ADJ
ajst-32394	360	12	machine	machine	NOUN
ajst-32394	360	13	learning	learning	NOUN
ajst-32394	360	14	approaches	approach	NOUN
ajst-32394	360	15	.	.	PUNCT
ajst-32394	361	1	toxicology	toxicology	NOUN
ajst-32394	361	2	,	,	PUNCT
ajst-32394	361	3	512	512	NUM
ajst-32394	361	4	,	,	PUNCT
ajst-32394	361	5	153678	153678	NUM
ajst-32394	361	6	.	.	PUNCT
ajst-32394	362	1	[	[	X
ajst-32394	362	2	51	51	NUM
ajst-32394	362	3	]	]	SYM
ajst-32394	362	4	kleinstreuer	kleinstreuer	PROPN
ajst-32394	362	5	,	,	PUNCT
ajst-32394	362	6	n.	n.	NOUN
ajst-32394	362	7	,	,	PUNCT
ajst-32394	362	8	zhu	zhu	PROPN
ajst-32394	362	9	,	,	PUNCT
ajst-32394	362	10	h.	h.	PROPN
ajst-32394	362	11	,	,	PUNCT
ajst-32394	362	12	zhang	zhang	PROPN
ajst-32394	362	13	,	,	PUNCT
ajst-32394	362	14	q.	q.	PROPN
ajst-32394	362	15	,	,	PUNCT
ajst-32394	362	16	&	&	CCONJ
ajst-32394	362	17	knudsen	knudsen	PROPN
ajst-32394	362	18	,	,	PUNCT
ajst-32394	362	19	t.	t.	PROPN
ajst-32394	362	20	(	(	PUNCT
ajst-32394	362	21	2025	2025	NUM
ajst-32394	362	22	)	)	PUNCT
ajst-32394	362	23	.	.	PUNCT
ajst-32394	363	1	explainable	explainable	ADJ
ajst-32394	363	2	deep	deep	ADJ
ajst-32394	363	3	learning	learning	NOUN
ajst-32394	363	4	for	for	ADP
ajst-32394	363	5	predicting	predict	VERB
ajst-32394	363	6	drug	drug	NOUN
ajst-32394	363	7	-	-	PUNCT
ajst-32394	363	8	induced	induce	VERB
ajst-32394	363	9	autoimmunity	autoimmunity	NOUN
ajst-32394	363	10	.	.	PUNCT
ajst-32394	364	1	chemical	chemical	ADJ
ajst-32394	364	2	research	research	NOUN
ajst-32394	364	3	in	in	ADP
ajst-32394	364	4	toxicology	toxicology	NOUN
ajst-32394	364	5	,	,	PUNCT
ajst-32394	364	6	38(6	38(6	NOUN
ajst-32394	364	7	)	)	PUNCT
ajst-32394	364	8	,	,	PUNCT
ajst-32394	364	9	1123–1135	1123–1135	NUM
ajst-32394	364	10	.	.	PUNCT
ajst-32394	365	1	[	[	X
ajst-32394	365	2	52	52	NUM
ajst-32394	365	3	]	]	PUNCT
ajst-32394	365	4	bryce	bryce	PROPN
ajst-32394	365	5	,	,	PUNCT
ajst-32394	365	6	s.	s.	PROPN
ajst-32394	365	7	m.	m.	PROPN
ajst-32394	365	8	,	,	PUNCT
ajst-32394	365	9	bernacki	bernacki	PROPN
ajst-32394	365	10	,	,	PUNCT
ajst-32394	365	11	d.	d.	PROPN
ajst-32394	365	12	t.	t.	PROPN
ajst-32394	365	13	,	,	PUNCT
ajst-32394	365	14	smith	smith	PROPN
ajst-32394	365	15	-	-	PUNCT
ajst-32394	365	16	roe	roe	PROPN
ajst-32394	365	17	,	,	PUNCT
ajst-32394	365	18	s.	s.	PROPN
ajst-32394	365	19	l.	l.	PROPN
ajst-32394	365	20	,	,	PUNCT
ajst-32394	365	21	et	et	PROPN
ajst-32394	365	22	al	al	PROPN
ajst-32394	365	23	.	.	PUNCT
ajst-32394	365	24	(	(	PUNCT
ajst-32394	365	25	2017	2017	NUM
ajst-32394	365	26	)	)	PUNCT
ajst-32394	365	27	.	.	PUNCT
ajst-32394	366	1	investigating	investigate	VERB
ajst-32394	366	2	the	the	DET
ajst-32394	366	3	generalizability	generalizability	NOUN
ajst-32394	366	4	of	of	ADP
ajst-32394	366	5	the	the	DET
ajst-32394	366	6	multiflow	multiflow	NOUN
ajst-32394	366	7	®	®	NOUN
ajst-32394	366	8	dna	dna	PROPN
ajst-32394	366	9	damage	damage	VERB
ajst-32394	366	10	assay	assay	NOUN
ajst-32394	366	11	and	and	CCONJ
ajst-32394	366	12	several	several	ADJ
ajst-32394	366	13	companion	companion	NOUN
ajst-32394	366	14	machine	machine	NOUN
ajst-32394	366	15	learning	learning	NOUN
ajst-32394	366	16	models	model	NOUN
ajst-32394	366	17	with	with	ADP
ajst-32394	366	18	a	a	DET
ajst-32394	366	19	set	set	NOUN
ajst-32394	366	20	of	of	ADP
ajst-32394	366	21	103	103	NUM
ajst-32394	366	22	diverse	diverse	ADJ
ajst-32394	366	23	test	test	NOUN
ajst-32394	366	24	chemicals	chemical	NOUN
ajst-32394	366	25	.	.	PUNCT
ajst-32394	367	1	toxicological	toxicological	ADJ
ajst-32394	367	2	sciences	science	NOUN
ajst-32394	367	3	,	,	PUNCT
ajst-32394	367	4	159(2	159(2	NUM
ajst-32394	367	5	)	)	PUNCT
ajst-32394	367	6	,	,	PUNCT
ajst-32394	367	7	287–296	287–296	NUM
ajst-32394	367	8	.	.	PUNCT
ajst-32394	368	1	[	[	X
ajst-32394	368	2	53	53	NUM
ajst-32394	368	3	]	]	PUNCT
ajst-32394	368	4	tonoyan	tonoyan	PROPN
ajst-32394	368	5	,	,	PUNCT
ajst-32394	368	6	a.	a.	PROPN
ajst-32394	368	7	,	,	PUNCT
ajst-32394	368	8	&	&	CCONJ
ajst-32394	368	9	siraki	siraki	PROPN
ajst-32394	368	10	,	,	PUNCT
ajst-32394	368	11	a.	a.	NOUN
ajst-32394	368	12	(	(	PUNCT
ajst-32394	368	13	2024	2024	NUM
ajst-32394	368	14	)	)	PUNCT
ajst-32394	368	15	.	.	PUNCT
ajst-32394	369	1	hidden	hide	VERB
ajst-32394	369	2	markov	markov	NOUN
ajst-32394	369	3	models	model	NOUN
ajst-32394	369	4	for	for	ADP
ajst-32394	369	5	temporal	temporal	ADJ
ajst-32394	369	6	biomarker	biomarker	NOUN
ajst-32394	369	7	discovery	discovery	NOUN
ajst-32394	369	8	in	in	ADP
ajst-32394	369	9	toxicokinetics	toxicokinetic	NOUN
ajst-32394	369	10	.	.	PUNCT
ajst-32394	370	1	toxicology	toxicology	NOUN
ajst-32394	370	2	and	and	CCONJ
ajst-32394	370	3	applied	apply	VERB
ajst-32394	370	4	pharmacology	pharmacology	NOUN
ajst-32394	370	5	,	,	PUNCT
ajst-32394	370	6	478	478	NUM
ajst-32394	370	7	,	,	PUNCT
ajst-32394	370	8	116712	116712	NUM
ajst-32394	370	9	.	.	PUNCT
ajst-32394	371	1	[	[	X
ajst-32394	371	2	54	54	NUM
ajst-32394	371	3	]	]	PUNCT
ajst-32394	371	4	bryce	bryce	PROPN
ajst-32394	371	5	,	,	PUNCT
ajst-32394	371	6	s.	s.	PROPN
ajst-32394	371	7	m.	m.	PROPN
ajst-32394	371	8	,	,	PUNCT
ajst-32394	371	9	bernacki	bernacki	PROPN
ajst-32394	371	10	,	,	PUNCT
ajst-32394	371	11	d.	d.	PROPN
ajst-32394	371	12	t.	t.	PROPN
ajst-32394	371	13	,	,	PUNCT
ajst-32394	371	14	smith	smith	PROPN
ajst-32394	371	15	-	-	PUNCT
ajst-32394	371	16	roe	roe	PROPN
ajst-32394	371	17	,	,	PUNCT
ajst-32394	371	18	s.	s.	PROPN
ajst-32394	371	19	l.	l.	PROPN
ajst-32394	371	20	,	,	PUNCT
ajst-32394	371	21	et	et	PROPN
ajst-32394	371	22	al	al	PROPN
ajst-32394	371	23	.	.	PUNCT
ajst-32394	371	24	(	(	PUNCT
ajst-32394	371	25	2017	2017	NUM
ajst-32394	371	26	)	)	PUNCT
ajst-32394	371	27	.	.	PUNCT
ajst-32394	372	1	machine	machine	NOUN
ajst-32394	372	2	learning	learning	NOUN
ajst-32394	372	3	enhances	enhance	VERB
ajst-32394	372	4	the	the	DET
ajst-32394	372	5	multiflow	multiflow	NOUN
ajst-32394	372	6	®	®	NOUN
ajst-32394	372	7	assay	assay	VERB
ajst-32394	372	8	for	for	ADP
ajst-32394	372	9	genotoxicity	genotoxicity	NOUN
ajst-32394	372	10	testing	testing	NOUN
ajst-32394	372	11	.	.	PUNCT
ajst-32394	373	1	mutation	mutation	NOUN
ajst-32394	373	2	research	research	NOUN
ajst-32394	373	3	/	/	SYM
ajst-32394	373	4	genetic	genetic	ADJ
ajst-32394	373	5	toxicology	toxicology	NOUN
ajst-32394	373	6	and	and	CCONJ
ajst-32394	373	7	environmental	environmental	ADJ
ajst-32394	373	8	mutagenesis	mutagenesis	NOUN
ajst-32394	373	9	,	,	PUNCT
ajst-32394	373	10	819	819	NUM
ajst-32394	373	11	,	,	PUNCT
ajst-32394	373	12	1–10	1–10	NOUN
ajst-32394	373	13	.	.	PUNCT
ajst-32394	374	1	[	[	X
ajst-32394	374	2	55	55	NUM
ajst-32394	374	3	]	]	PUNCT
ajst-32394	374	4	giordano	giordano	PROPN
ajst-32394	374	5	,	,	PUNCT
ajst-32394	374	6	m.	m.	NOUN
ajst-32394	374	7	,	,	PUNCT
ajst-32394	374	8	tripathi	tripathi	PROPN
ajst-32394	374	9	,	,	PUNCT
ajst-32394	374	10	k.	k.	PROPN
ajst-32394	375	1	p.	p.	PROPN
ajst-32394	375	2	,	,	PUNCT
ajst-32394	375	3	&	&	CCONJ
ajst-32394	375	4	guarracino	guarracino	PROPN
ajst-32394	375	5	,	,	PUNCT
ajst-32394	375	6	m.	m.	PROPN
ajst-32394	375	7	r.	r.	PROPN
ajst-32394	375	8	(	(	PUNCT
ajst-32394	375	9	2018	2018	NUM
ajst-32394	375	10	)	)	PUNCT
ajst-32394	375	11	.	.	PUNCT
ajst-32394	376	1	ensemble	ensemble	ADJ
ajst-32394	376	2	of	of	ADP
ajst-32394	376	3	rankers	ranker	NOUN
ajst-32394	376	4	for	for	ADP
ajst-32394	376	5	efficient	efficient	ADJ
ajst-32394	376	6	gene	gene	NOUN
ajst-32394	376	7	signature	signature	NOUN
ajst-32394	376	8	extraction	extraction	NOUN
ajst-32394	376	9	in	in	ADP
ajst-32394	376	10	smoke	smoke	NOUN
ajst-32394	376	11	exposure	exposure	NOUN
ajst-32394	376	12	classification	classification	NOUN
ajst-32394	376	13	.	.	PUNCT
ajst-32394	377	1	bmc	bmc	ADJ
ajst-32394	377	2	bioinformatics	bioinformatic	NOUN
ajst-32394	377	3	,	,	PUNCT
ajst-32394	377	4	19(suppl	19(suppl	NUM
ajst-32394	377	5	2	2	NUM
ajst-32394	377	6	)	)	PUNCT
ajst-32394	377	7	,	,	PUNCT
ajst-32394	377	8	48	48	NUM
ajst-32394	377	9	.	.	PUNCT
ajst-32394	378	1	[	[	X
ajst-32394	378	2	56	56	NUM
ajst-32394	378	3	]	]	X
ajst-32394	378	4	ramm	ramm	PROPN
ajst-32394	378	5	,	,	PUNCT
ajst-32394	378	6	s.	s.	PROPN
ajst-32394	378	7	,	,	PUNCT
ajst-32394	378	8	todorov	todorov	NOUN
ajst-32394	378	9	,	,	PUNCT
ajst-32394	378	10	p.	p.	PROPN
ajst-32394	378	11	,	,	PUNCT
ajst-32394	378	12	chandrasekaran	chandrasekaran	ADJ
ajst-32394	378	13	,	,	PUNCT
ajst-32394	378	14	v.	v.	ADV
ajst-32394	378	15	,	,	PUNCT
ajst-32394	378	16	et	et	PROPN
ajst-32394	378	17	al	al	PROPN
ajst-32394	378	18	.	.	PROPN
ajst-32394	379	1	(	(	PUNCT
ajst-32394	379	2	2019	2019	NUM
ajst-32394	379	3	)	)	PUNCT
ajst-32394	379	4	.	.	PUNCT
ajst-32394	380	1	a	a	DET
ajst-32394	380	2	systems	system	NOUN
ajst-32394	380	3	toxicology	toxicology	NOUN
ajst-32394	380	4	approach	approach	NOUN
ajst-32394	380	5	for	for	ADP
ajst-32394	380	6	the	the	DET
ajst-32394	380	7	prediction	prediction	NOUN
ajst-32394	380	8	of	of	ADP
ajst-32394	380	9	kidney	kidney	NOUN
ajst-32394	380	10	toxicity	toxicity	NOUN
ajst-32394	380	11	and	and	CCONJ
ajst-32394	380	12	its	its	PRON
ajst-32394	380	13	mechanisms	mechanism	NOUN
ajst-32394	380	14	in	in	ADP
ajst-32394	380	15	vitro	vitro	X
ajst-32394	380	16	.	.	PUNCT
ajst-32394	381	1	toxicological	toxicological	ADJ
ajst-32394	381	2	sciences	science	NOUN
ajst-32394	381	3	,	,	PUNCT
ajst-32394	381	4	169(1	169(1	NUM
ajst-32394	381	5	)	)	PUNCT
ajst-32394	381	6	,	,	PUNCT
ajst-32394	381	7	54–69	54–69	X
ajst-32394	381	8	.	.	PUNCT
ajst-32394	382	1	[	[	X
ajst-32394	382	2	57	57	NUM
ajst-32394	382	3	]	]	PUNCT
ajst-32394	382	4	tonoyan	tonoyan	PROPN
ajst-32394	382	5	,	,	PUNCT
ajst-32394	382	6	a.	a.	PROPN
ajst-32394	382	7	,	,	PUNCT
ajst-32394	382	8	&	&	CCONJ
ajst-32394	382	9	siraki	siraki	PROPN
ajst-32394	382	10	,	,	PUNCT
ajst-32394	382	11	a.	a.	NOUN
ajst-32394	382	12	(	(	PUNCT
ajst-32394	382	13	2024	2024	NUM
ajst-32394	382	14	)	)	PUNCT
ajst-32394	382	15	.	.	PUNCT
ajst-32394	383	1	federated	federate	VERB
ajst-32394	383	2	learning	learning	NOUN
ajst-32394	383	3	for	for	ADP
ajst-32394	383	4	multi	multi	ADJ
ajst-32394	383	5	-	-	ADJ
ajst-32394	383	6	omics	omic	NOUN
ajst-32394	383	7	biomarker	biomarker	NOUN
ajst-32394	383	8	discovery	discovery	NOUN
ajst-32394	383	9	in	in	ADP
ajst-32394	383	10	nephrotoxicity	nephrotoxicity	NOUN
ajst-32394	383	11	.	.	PUNCT
ajst-32394	384	1	frontiers	frontier	NOUN
ajst-32394	384	2	in	in	ADP
ajst-32394	384	3	toxicology	toxicology	NOUN
ajst-32394	384	4	,	,	PUNCT
ajst-32394	384	5	6	6	NUM
ajst-32394	384	6	,	,	PUNCT
ajst-32394	384	7	112233	112233	NUM
ajst-32394	384	8	.	.	PUNCT
ajst-32394	385	1	[	[	X
ajst-32394	385	2	58	58	NUM
ajst-32394	385	3	]	]	X
ajst-32394	385	4	vesselinov	vesselinov	NOUN
ajst-32394	385	5	,	,	PUNCT
ajst-32394	385	6	v.	v.	PROPN
ajst-32394	385	7	v.	v.	ADP
ajst-32394	385	8	,	,	PUNCT
ajst-32394	385	9	alexandrov	alexandrov	PROPN
ajst-32394	385	10	,	,	PUNCT
ajst-32394	385	11	b.	b.	PROPN
ajst-32394	385	12	s.	s.	PROPN
ajst-32394	385	13	,	,	PUNCT
ajst-32394	385	14	&	&	CCONJ
ajst-32394	385	15	o’malley	o’malley	PROPN
ajst-32394	385	16	,	,	PUNCT
ajst-32394	385	17	d.	d.	PROPN
ajst-32394	385	18	(	(	PUNCT
ajst-32394	385	19	2017	2017	NUM
ajst-32394	385	20	)	)	PUNCT
ajst-32394	385	21	.	.	PUNCT
ajst-32394	386	1	contaminant	contaminant	NOUN
ajst-32394	386	2	source	source	NOUN
ajst-32394	386	3	identification	identification	NOUN
ajst-32394	386	4	using	use	VERB
ajst-32394	386	5	semi	semi	ADJ
ajst-32394	386	6	-	-	ADJ
ajst-32394	386	7	supervised	supervised	ADJ
ajst-32394	386	8	machine	machine	NOUN
ajst-32394	386	9	learning	learning	NOUN
ajst-32394	386	10	.	.	PUNCT
ajst-32394	387	1	journal	journal	PROPN
ajst-32394	387	2	of	of	ADP
ajst-32394	387	3	contaminant	contaminant	ADJ
ajst-32394	387	4	hydrology	hydrology	NOUN
ajst-32394	387	5	,	,	PUNCT
ajst-32394	387	6	208	208	NUM
ajst-32394	387	7	,	,	PUNCT
ajst-32394	387	8	11–19	11–19	NUM
ajst-32394	387	9	.	.	PUNCT
ajst-32394	388	1	[	[	X
ajst-32394	388	2	59	59	NUM
ajst-32394	388	3	]	]	X
ajst-32394	388	4	hossain	hossain	PROPN
ajst-32394	388	5	,	,	PUNCT
ajst-32394	388	6	m.	m.	NOUN
ajst-32394	388	7	m.	m.	NOUN
ajst-32394	388	8	,	,	PUNCT
ajst-32394	388	9	&	&	CCONJ
ajst-32394	388	10	roy	roy	PROPN
ajst-32394	388	11	,	,	PUNCT
ajst-32394	388	12	k.	k.	PROPN
ajst-32394	388	13	(	(	PUNCT
ajst-32394	388	14	2024	2024	NUM
ajst-32394	388	15	)	)	PUNCT
ajst-32394	388	16	.	.	PUNCT
ajst-32394	389	1	the	the	DET
ajst-32394	389	2	development	development	NOUN
ajst-32394	389	3	of	of	ADP
ajst-32394	389	4	classification	classification	NOUN
ajst-32394	389	5	-	-	PUNCT
ajst-32394	389	6	based	base	VERB
ajst-32394	389	7	machine	machine	NOUN
ajst-32394	389	8	-	-	PUNCT
ajst-32394	389	9	learning	learn	VERB
ajst-32394	389	10	models	model	NOUN
ajst-32394	389	11	for	for	ADP
ajst-32394	389	12	the	the	DET
ajst-32394	389	13	toxicity	toxicity	NOUN
ajst-32394	389	14	assessment	assessment	NOUN
ajst-32394	389	15	of	of	ADP
ajst-32394	389	16	chemicals	chemical	NOUN
ajst-32394	389	17	associated	associate	VERB
ajst-32394	389	18	with	with	ADP
ajst-32394	389	19	plastic	plastic	ADJ
ajst-32394	389	20	packaging	packaging	NOUN
ajst-32394	389	21	.	.	PUNCT
ajst-32394	390	1	journal	journal	NOUN
ajst-32394	390	2	of	of	ADP
ajst-32394	390	3	hazardous	hazardous	ADJ
ajst-32394	390	4	materials	material	NOUN
ajst-32394	390	5	,	,	PUNCT
ajst-32394	390	6	465	465	NUM
ajst-32394	390	7	,	,	PUNCT
ajst-32394	390	8	133234	133234	NUM
ajst-32394	390	9	.	.	PUNCT
ajst-32394	391	1	[	[	X
ajst-32394	391	2	60	60	NUM
ajst-32394	391	3	]	]	X
ajst-32394	391	4	wang	wang	PROPN
ajst-32394	391	5	,	,	PUNCT
ajst-32394	391	6	y.	y.	PROPN
ajst-32394	391	7	,	,	PUNCT
ajst-32394	391	8	&	&	CCONJ
ajst-32394	391	9	jeon	jeon	PROPN
ajst-32394	391	10	,	,	PUNCT
ajst-32394	391	11	h.	h.	PROPN
ajst-32394	391	12	(	(	PUNCT
ajst-32394	391	13	2022	2022	NUM
ajst-32394	391	14	)	)	PUNCT
ajst-32394	391	15	.	.	PUNCT
ajst-32394	392	1	3d	3d	NUM
ajst-32394	392	2	cell	cell	NOUN
ajst-32394	392	3	cultures	culture	NOUN
ajst-32394	392	4	toward	toward	ADP
ajst-32394	392	5	quantitative	quantitative	ADJ
ajst-32394	392	6	high	high	ADJ
ajst-32394	392	7	-	-	PUNCT
ajst-32394	392	8	throughput	throughput	NOUN
ajst-32394	392	9	drug	drug	NOUN
ajst-32394	392	10	screening	screening	NOUN
ajst-32394	392	11	.	.	PUNCT
ajst-32394	393	1	trends	trend	NOUN
ajst-32394	393	2	in	in	ADP
ajst-32394	393	3	pharmacological	pharmacological	ADJ
ajst-32394	393	4	sciences	science	NOUN
ajst-32394	393	5	,	,	PUNCT
ajst-32394	393	6	43(7	43(7	NUM
ajst-32394	393	7	)	)	PUNCT
ajst-32394	393	8	,	,	PUNCT
ajst-32394	393	9	569–581	569–581	NUM
ajst-32394	393	10	.	.	PUNCT
ajst-32394	394	1	[	[	X
ajst-32394	394	2	61	61	NUM
ajst-32394	394	3	]	]	PUNCT
ajst-32394	394	4	pang	pang	NOUN
ajst-32394	394	5	,	,	PUNCT
ajst-32394	394	6	x.	x.	PROPN
ajst-32394	394	7	,	,	PUNCT
ajst-32394	394	8	li	li	PROPN
ajst-32394	394	9	,	,	PUNCT
ajst-32394	394	10	s.	s.	PROPN
ajst-32394	394	11	,	,	PUNCT
ajst-32394	394	12	zhang	zhang	PROPN
ajst-32394	394	13	,	,	PUNCT
ajst-32394	394	14	y.	y.	PROPN
ajst-32394	394	15	,	,	PUNCT
ajst-32394	394	16	&	&	CCONJ
ajst-32394	394	17	xia	xia	PROPN
ajst-32394	394	18	,	,	PUNCT
ajst-32394	394	19	m.	m.	NOUN
ajst-32394	394	20	(	(	PUNCT
ajst-32394	394	21	2025	2025	NUM
ajst-32394	394	22	)	)	PUNCT
ajst-32394	394	23	.	.	PUNCT
ajst-32394	395	1	neutox	neutox	PROPN
ajst-32394	395	2	2.0	2.0	NUM
ajst-32394	395	3	:	:	PUNCT
ajst-32394	395	4	a	a	DET
ajst-32394	395	5	deep	deep	ADJ
ajst-32394	395	6	learning	learning	NOUN
ajst-32394	395	7	framework	framework	NOUN
ajst-32394	395	8	for	for	ADP
ajst-32394	395	9	neurotoxicity	neurotoxicity	NOUN
ajst-32394	395	10	prediction	prediction	NOUN
ajst-32394	395	11	using	use	VERB
ajst-32394	395	12	3d	3d	NUM
ajst-32394	395	13	cell	cell	NOUN
ajst-32394	395	14	cultures	culture	NOUN
ajst-32394	395	15	.	.	PUNCT
ajst-32394	396	1	toxicological	toxicological	ADJ
ajst-32394	396	2	sciences	science	NOUN
ajst-32394	396	3	,	,	PUNCT
ajst-32394	396	4	186(2	186(2	NUM
ajst-32394	396	5	)	)	PUNCT
ajst-32394	396	6	,	,	PUNCT
ajst-32394	396	7	234–245	234–245	NUM
ajst-32394	396	8	.	.	PUNCT
ajst-32394	397	1	[	[	X
ajst-32394	397	2	62	62	NUM
ajst-32394	397	3	]	]	SYM
ajst-32394	397	4	hesse	hesse	PROPN
ajst-32394	397	5	,	,	PUNCT
ajst-32394	397	6	l.	l.	PROPN
ajst-32394	397	7	,	,	PUNCT
ajst-32394	397	8	müller	müller	PROPN
ajst-32394	397	9	,	,	PUNCT
ajst-32394	397	10	r.	r.	PROPN
ajst-32394	397	11	,	,	PUNCT
ajst-32394	397	12	&	&	CCONJ
ajst-32394	397	13	schneider	schneider	PROPN
ajst-32394	397	14	,	,	PUNCT
ajst-32394	397	15	g.	g.	PROPN
ajst-32394	397	16	(	(	PUNCT
ajst-32394	397	17	2025	2025	NUM
ajst-32394	397	18	)	)	PUNCT
ajst-32394	397	19	.	.	PUNCT
ajst-32394	398	1	deep	deep	ADJ
ajst-32394	398	2	learning	learn	VERB
ajst-32394	398	3	for	for	ADP
ajst-32394	398	4	hit	hit	VERB
ajst-32394	398	5	prioritization	prioritization	NOUN
ajst-32394	398	6	in	in	ADP
ajst-32394	398	7	high	high	ADJ
ajst-32394	398	8	-	-	PUNCT
ajst-32394	398	9	throughput	throughput	NOUN
ajst-32394	398	10	screening	screening	NOUN
ajst-32394	398	11	.	.	PUNCT
ajst-32394	399	1	acs	acs	PROPN
ajst-32394	399	2	central	central	PROPN
ajst-32394	399	3	science	science	PROPN
ajst-32394	399	4	,	,	PUNCT
ajst-32394	399	5	11(3	11(3	NUM
ajst-32394	399	6	)	)	PUNCT
ajst-32394	399	7	,	,	PUNCT
ajst-32394	399	8	456–465	456–465	NUM
ajst-32394	399	9	.	.	PUNCT
ajst-32394	400	1	[	[	X
ajst-32394	400	2	63	63	NUM
ajst-32394	400	3	]	]	PUNCT
ajst-32394	400	4	gravina	gravina	PROPN
ajst-32394	400	5	,	,	PUNCT
ajst-32394	400	6	a.	a.	PROPN
ajst-32394	400	7	,	,	PUNCT
ajst-32394	400	8	wilson	wilson	PROPN
ajst-32394	400	9	,	,	PUNCT
ajst-32394	400	10	j.	j.	PROPN
ajst-32394	400	11	l.	l.	PROPN
ajst-32394	400	12	,	,	PUNCT
ajst-32394	400	13	bacciu	bacciu	PROPN
ajst-32394	400	14	,	,	PUNCT
ajst-32394	400	15	d.	d.	PROPN
ajst-32394	400	16	,	,	PUNCT
ajst-32394	400	17	et	et	PROPN
ajst-32394	400	18	al	al	PROPN
ajst-32394	400	19	.	.	PROPN
ajst-32394	400	20	(	(	PUNCT
ajst-32394	400	21	2022	2022	NUM
ajst-32394	400	22	)	)	PUNCT
ajst-32394	400	23	.	.	PUNCT
ajst-32394	401	1	controlling	control	VERB
ajst-32394	401	2	astrocyte	astrocyte	NOUN
ajst-32394	401	3	-	-	PUNCT
ajst-32394	401	4	mediated	mediate	VERB
ajst-32394	401	5	synaptic	synaptic	ADJ
ajst-32394	401	6	pruning	pruning	NOUN
ajst-32394	401	7	signals	signal	NOUN
ajst-32394	401	8	for	for	ADP
ajst-32394	401	9	schizophrenia	schizophrenia	NOUN
ajst-32394	401	10	drug	drug	NOUN
ajst-32394	401	11	repurposing	repurpose	VERB
ajst-32394	401	12	with	with	ADP
ajst-32394	401	13	deep	deep	ADJ
ajst-32394	401	14	graph	graph	NOUN
ajst-32394	401	15	networks	network	NOUN
ajst-32394	401	16	.	.	PUNCT
ajst-32394	402	1	plos	plos	PROPN
ajst-32394	402	2	computational	computational	ADJ
ajst-32394	402	3	biology	biology	NOUN
ajst-32394	402	4	,	,	PUNCT
ajst-32394	402	5	18(5	18(5	NUM
ajst-32394	402	6	)	)	PUNCT
ajst-32394	402	7	,	,	PUNCT
ajst-32394	402	8	e1010170	e1010170	VERB
ajst-32394	402	9	.	.	NOUN
ajst-32394	403	1	214	214	NUM
ajst-32394	404	1	[	[	X
ajst-32394	404	2	64	64	NUM
ajst-32394	404	3	]	]	PUNCT
ajst-32394	404	4	atomnet	atomnet	NOUN
ajst-32394	404	5	study	study	NOUN
ajst-32394	404	6	.	.	PUNCT
ajst-32394	405	1	(	(	PUNCT
ajst-32394	405	2	2025	2025	NUM
ajst-32394	405	3	)	)	PUNCT
ajst-32394	405	4	.	.	PUNCT
ajst-32394	406	1	graph	graph	NOUN
ajst-32394	406	2	machine	machine	NOUN
ajst-32394	406	3	learning	learning	NOUN
ajst-32394	406	4	for	for	ADP
ajst-32394	406	5	phenotypic	phenotypic	ADJ
ajst-32394	406	6	screening	screening	NOUN
ajst-32394	406	7	in	in	ADP
ajst-32394	406	8	toxicology	toxicology	NOUN
ajst-32394	406	9	.	.	PUNCT
ajst-32394	407	1	nature	nature	NOUN
ajst-32394	407	2	machine	machine	NOUN
ajst-32394	407	3	intelligence	intelligence	NOUN
ajst-32394	407	4	,	,	PUNCT
ajst-32394	407	5	7(4	7(4	NUM
ajst-32394	407	6	)	)	PUNCT
ajst-32394	407	7	,	,	PUNCT
ajst-32394	407	8	321–330	321–330	NUM
ajst-32394	407	9	.	.	PUNCT
ajst-32394	408	1	[	[	X
ajst-32394	408	2	65	65	NUM
ajst-32394	408	3	]	]	X
ajst-32394	408	4	schrödinger	schrödinger	NOUN
ajst-32394	408	5	.	.	PUNCT
ajst-32394	409	1	(	(	PUNCT
ajst-32394	409	2	2025	2025	NUM
ajst-32394	409	3	)	)	PUNCT
ajst-32394	409	4	.	.	PUNCT
ajst-32394	410	1	deepauto	deepauto	NOUN
ajst-32394	410	2	qsar	qsar	PROPN
ajst-32394	410	3	:	:	PUNCT
ajst-32394	410	4	automated	automate	VERB
ajst-32394	410	5	pipeline	pipeline	NOUN
ajst-32394	410	6	for	for	ADP
ajst-32394	410	7	solubility	solubility	NOUN
ajst-32394	410	8	and	and	CCONJ
ajst-32394	410	9	herg	herg	PROPN
ajst-32394	410	10	prediction	prediction	NOUN
ajst-32394	410	11	.	.	PUNCT
ajst-32394	411	1	journal	journal	PROPN
ajst-32394	411	2	of	of	ADP
ajst-32394	411	3	chemical	chemical	ADJ
ajst-32394	411	4	information	information	NOUN
ajst-32394	411	5	and	and	CCONJ
ajst-32394	411	6	modeling	modeling	NOUN
ajst-32394	411	7	,	,	PUNCT
ajst-32394	411	8	65(6	65(6	NUM
ajst-32394	411	9	)	)	PUNCT
ajst-32394	411	10	,	,	PUNCT
ajst-32394	411	11	1789–1801	1789–1801	NUM
ajst-32394	411	12	.	.	PUNCT
ajst-32394	412	1	[	[	X
ajst-32394	412	2	66	66	NUM
ajst-32394	412	3	]	]	PUNCT
ajst-32394	412	4	schrödinger	schrödinger	NOUN
ajst-32394	412	5	.	.	PUNCT
ajst-32394	413	1	(	(	PUNCT
ajst-32394	413	2	2025	2025	NUM
ajst-32394	413	3	)	)	PUNCT
ajst-32394	413	4	.	.	PUNCT
ajst-32394	414	1	interpretable	interpretable	ADJ
ajst-32394	414	2	machine	machine	NOUN
ajst-32394	414	3	learning	learning	NOUN
ajst-32394	414	4	for	for	ADP
ajst-32394	414	5	regulatory	regulatory	ADJ
ajst-32394	414	6	toxicology	toxicology	NOUN
ajst-32394	414	7	.	.	PUNCT
ajst-32394	415	1	regulatory	regulatory	ADJ
ajst-32394	415	2	toxicology	toxicology	NOUN
ajst-32394	415	3	and	and	CCONJ
ajst-32394	415	4	pharmacology	pharmacology	NOUN
ajst-32394	415	5	,	,	PUNCT
ajst-32394	415	6	128	128	NUM
ajst-32394	415	7	,	,	PUNCT
ajst-32394	415	8	105123	105123	NUM
ajst-32394	415	9	.	.	PUNCT
ajst-32394	416	1	[	[	X
ajst-32394	416	2	67	67	NUM
ajst-32394	416	3	]	]	X
ajst-32394	416	4	ji	ji	PROPN
ajst-32394	416	5	,	,	PUNCT
ajst-32394	416	6	y.	y.	PROPN
ajst-32394	416	7	,	,	PUNCT
ajst-32394	416	8	zhang	zhang	PROPN
ajst-32394	416	9	,	,	PUNCT
ajst-32394	416	10	l.	l.	PROPN
ajst-32394	416	11	,	,	PUNCT
ajst-32394	416	12	wang	wang	PROPN
ajst-32394	416	13	,	,	PUNCT
ajst-32394	416	14	h.	h.	PROPN
ajst-32394	416	15	,	,	PUNCT
ajst-32394	416	16	&	&	CCONJ
ajst-32394	416	17	chen	chen	PROPN
ajst-32394	416	18	,	,	PUNCT
ajst-32394	416	19	x.	x.	PROPN
ajst-32394	416	20	(	(	PUNCT
ajst-32394	416	21	2025	2025	NUM
ajst-32394	416	22	)	)	PUNCT
ajst-32394	416	23	.	.	PUNCT
ajst-32394	417	1	graph	graph	NOUN
ajst-32394	417	2	neural	neural	ADJ
ajst-32394	417	3	networks	network	NOUN
ajst-32394	417	4	for	for	ADP
ajst-32394	417	5	nanomaterial	nanomaterial	ADJ
ajst-32394	417	6	genotoxicity	genotoxicity	NOUN
ajst-32394	417	7	prediction	prediction	NOUN
ajst-32394	417	8	.	.	PUNCT
ajst-32394	418	1	acs	acs	PROPN
ajst-32394	418	2	nano	nano	PROPN
ajst-32394	418	3	,	,	PUNCT
ajst-32394	418	4	19(5	19(5	NUM
ajst-32394	418	5	)	)	PUNCT
ajst-32394	418	6	,	,	PUNCT
ajst-32394	418	7	6789–6800	6789–6800	NUM
ajst-32394	418	8	.	.	PUNCT
ajst-32394	419	1	[	[	X
ajst-32394	419	2	68	68	NUM
ajst-32394	419	3	]	]	X
ajst-32394	419	4	karantanas	karantana	NOUN
ajst-32394	419	5	,	,	PUNCT
ajst-32394	419	6	a.	a.	PROPN
ajst-32394	419	7	h.	h.	PROPN
ajst-32394	419	8	,	,	PUNCT
ajst-32394	419	9	koumakis	koumakis	PROPN
ajst-32394	419	10	,	,	PUNCT
ajst-32394	419	11	l.	l.	PROPN
ajst-32394	419	12	,	,	PUNCT
ajst-32394	419	13	marias	marias	PROPN
ajst-32394	419	14	,	,	PUNCT
ajst-32394	419	15	k.	k.	PROPN
ajst-32394	419	16	,	,	PUNCT
ajst-32394	419	17	et	et	PROPN
ajst-32394	419	18	al	al	PROPN
ajst-32394	419	19	.	.	PROPN
ajst-32394	419	20	(	(	PUNCT
ajst-32394	419	21	2020	2020	NUM
ajst-32394	419	22	)	)	PUNCT
ajst-32394	419	23	.	.	PUNCT
ajst-32394	420	1	artificial	artificial	ADJ
ajst-32394	420	2	intelligence	intelligence	NOUN
ajst-32394	420	3	radiogenomics	radiogenomic	NOUN
ajst-32394	420	4	for	for	ADP
ajst-32394	420	5	advancing	advance	VERB
ajst-32394	420	6	precision	precision	NOUN
ajst-32394	420	7	and	and	CCONJ
ajst-32394	420	8	effectiveness	effectiveness	NOUN
ajst-32394	420	9	in	in	ADP
ajst-32394	420	10	oncologic	oncologic	PROPN
ajst-32394	420	11	care	care	NOUN
ajst-32394	420	12	.	.	PUNCT
ajst-32394	421	1	international	international	ADJ
ajst-32394	421	2	journal	journal	PROPN
ajst-32394	421	3	of	of	ADP
ajst-32394	421	4	oncology	oncology	NOUN
ajst-32394	421	5	,	,	PUNCT
ajst-32394	421	6	57(1	57(1	NUM
ajst-32394	421	7	)	)	PUNCT
ajst-32394	421	8	,	,	PUNCT
ajst-32394	421	9	43–53	43–53	NOUN
ajst-32394	421	10	.	.	PUNCT
ajst-32394	422	1	[	[	X
ajst-32394	422	2	69	69	NUM
ajst-32394	422	3	]	]	X
ajst-32394	422	4	chen	chen	PROPN
ajst-32394	422	5	,	,	PUNCT
ajst-32394	422	6	z.	z.	PROPN
ajst-32394	422	7	,	,	PUNCT
ajst-32394	422	8	hu	hu	PROPN
ajst-32394	422	9	,	,	PUNCT
ajst-32394	422	10	l.	l.	PROPN
ajst-32394	422	11	,	,	PUNCT
ajst-32394	422	12	zhang	zhang	PROPN
ajst-32394	422	13	,	,	PUNCT
ajst-32394	422	14	b.	b.	PROPN
ajst-32394	422	15	t.	t.	PROPN
ajst-32394	422	16	,	,	PUNCT
ajst-32394	422	17	et	et	PROPN
ajst-32394	422	18	al	al	PROPN
ajst-32394	422	19	.	.	PUNCT
ajst-32394	422	20	(	(	PUNCT
ajst-32394	422	21	2021	2021	NUM
ajst-32394	422	22	)	)	PUNCT
ajst-32394	422	23	.	.	PUNCT
ajst-32394	423	1	artificial	artificial	ADJ
ajst-32394	423	2	intelligence	intelligence	NOUN
ajst-32394	423	3	in	in	ADP
ajst-32394	423	4	aptamer	aptamer	PROPN
ajst-32394	423	5	–	–	PUNCT
ajst-32394	423	6	target	target	NOUN
ajst-32394	423	7	binding	bind	VERB
ajst-32394	423	8	prediction	prediction	NOUN
ajst-32394	423	9	.	.	PUNCT
ajst-32394	424	1	international	international	ADJ
ajst-32394	424	2	journal	journal	NOUN
ajst-32394	424	3	of	of	ADP
ajst-32394	424	4	molecular	molecular	ADJ
ajst-32394	424	5	sciences	science	NOUN
ajst-32394	424	6	,	,	PUNCT
ajst-32394	424	7	22(13	22(13	NUM
ajst-32394	424	8	)	)	PUNCT
ajst-32394	424	9	,	,	PUNCT
ajst-32394	424	10	7135	7135	NUM
ajst-32394	424	11	.	.	PUNCT
ajst-32394	425	1	[	[	X
ajst-32394	425	2	70	70	NUM
ajst-32394	425	3	]	]	X
ajst-32394	425	4	wang	wang	PROPN
ajst-32394	425	5	,	,	PUNCT
ajst-32394	425	6	h.	h.	PROPN
ajst-32394	425	7	,	,	PUNCT
ajst-32394	425	8	li	li	PROPN
ajst-32394	425	9	,	,	PUNCT
ajst-32394	425	10	y.	y.	PROPN
ajst-32394	425	11	,	,	PUNCT
ajst-32394	425	12	zhang	zhang	PROPN
ajst-32394	425	13	,	,	PUNCT
ajst-32394	425	14	q.	q.	PROPN
ajst-32394	425	15	,	,	PUNCT
ajst-32394	425	16	&	&	CCONJ
ajst-32394	425	17	liu	liu	PROPN
ajst-32394	425	18	,	,	PUNCT
ajst-32394	425	19	j.	j.	PROPN
ajst-32394	425	20	(	(	PUNCT
ajst-32394	425	21	2024	2024	NUM
ajst-32394	425	22	)	)	PUNCT
ajst-32394	425	23	.	.	PUNCT
ajst-32394	426	1	aptadiff	aptadiff	PROPN
ajst-32394	426	2	:	:	PUNCT
ajst-32394	426	3	diffusion	diffusion	NOUN
ajst-32394	426	4	models	model	NOUN
ajst-32394	426	5	for	for	ADP
ajst-32394	426	6	de	de	X
ajst-32394	426	7	novo	novo	NOUN
ajst-32394	426	8	aptamer	aptamer	PROPN
ajst-32394	426	9	generation	generation	NOUN
ajst-32394	426	10	.	.	PUNCT
ajst-32394	427	1	nature	nature	NOUN
ajst-32394	427	2	communications	communication	NOUN
ajst-32394	427	3	,	,	PUNCT
ajst-32394	427	4	15	15	NUM
ajst-32394	427	5	,	,	PUNCT
ajst-32394	427	6	4567	4567	NUM
ajst-32394	427	7	.	.	PUNCT
ajst-32394	428	1	[	[	X
ajst-32394	428	2	71	71	NUM
ajst-32394	428	3	]	]	X
ajst-32394	428	4	liu	liu	PROPN
ajst-32394	428	5	,	,	PUNCT
ajst-32394	428	6	j.	j.	PROPN
ajst-32394	428	7	,	,	PUNCT
ajst-32394	428	8	zhang	zhang	PROPN
ajst-32394	428	9	,	,	PUNCT
ajst-32394	428	10	y.	y.	PROPN
ajst-32394	428	11	,	,	PUNCT
ajst-32394	428	12	wang	wang	PROPN
ajst-32394	428	13	,	,	PUNCT
ajst-32394	428	14	h.	h.	PROPN
ajst-32394	428	15	,	,	PUNCT
ajst-32394	428	16	&	&	CCONJ
ajst-32394	428	17	chen	chen	PROPN
ajst-32394	428	18	,	,	PUNCT
ajst-32394	428	19	x.	x.	PROPN
ajst-32394	428	20	(	(	PUNCT
ajst-32394	428	21	2025	2025	NUM
ajst-32394	428	22	)	)	PUNCT
ajst-32394	428	23	.	.	PUNCT
ajst-32394	429	1	transfer	transfer	NOUN
ajst-32394	429	2	learning	learning	NOUN
ajst-32394	429	3	for	for	ADP
ajst-32394	429	4	rna	rna	NOUN
ajst-32394	429	5	-	-	PUNCT
ajst-32394	429	6	protein	protein	NOUN
ajst-32394	429	7	interaction	interaction	NOUN
ajst-32394	429	8	prediction	prediction	NOUN
ajst-32394	429	9	in	in	ADP
ajst-32394	429	10	viral	viral	ADJ
ajst-32394	429	11	toxicology	toxicology	NOUN
ajst-32394	429	12	.	.	PUNCT
ajst-32394	430	1	bioinformatics	bioinformatic	NOUN
ajst-32394	430	2	,	,	PUNCT
ajst-32394	430	3	41(8	41(8	PROPN
ajst-32394	430	4	)	)	PUNCT
ajst-32394	430	5	,	,	PUNCT
ajst-32394	430	6	2345–2354	2345–2354	NUM
ajst-32394	430	7	.	.	PUNCT
ajst-32394	431	1	[	[	X
ajst-32394	431	2	72	72	NUM
ajst-32394	431	3	]	]	SYM
ajst-32394	431	4	setiya	setiya	NOUN
ajst-32394	431	5	,	,	PUNCT
ajst-32394	431	6	a.	a.	PROPN
ajst-32394	431	7	,	,	PUNCT
ajst-32394	431	8	jani	jani	PROPN
ajst-32394	431	9	,	,	PUNCT
ajst-32394	431	10	v.	v.	PROPN
ajst-32394	431	11	,	,	PUNCT
ajst-32394	431	12	sonavane	sonavane	NOUN
ajst-32394	431	13	,	,	PUNCT
ajst-32394	431	14	u.	u.	PROPN
ajst-32394	431	15	,	,	PUNCT
ajst-32394	431	16	et	et	PROPN
ajst-32394	431	17	al	al	PROPN
ajst-32394	431	18	.	.	PUNCT
ajst-32394	431	19	(	(	PUNCT
ajst-32394	431	20	2024	2024	NUM
ajst-32394	431	21	)	)	PUNCT
ajst-32394	431	22	.	.	PUNCT
ajst-32394	432	1	moltoxpred	moltoxpred	ADJ
ajst-32394	432	2	:	:	PUNCT
ajst-32394	432	3	small	small	ADJ
ajst-32394	432	4	molecule	molecule	NOUN
ajst-32394	432	5	toxicity	toxicity	NOUN
ajst-32394	432	6	prediction	prediction	NOUN
ajst-32394	432	7	using	use	VERB
ajst-32394	432	8	machine	machine	NOUN
ajst-32394	432	9	learning	learning	NOUN
ajst-32394	432	10	approach	approach	NOUN
ajst-32394	432	11	.	.	PUNCT
ajst-32394	433	1	rsc	rsc	PROPN
ajst-32394	433	2	advances	advance	NOUN
ajst-32394	433	3	,	,	PUNCT
ajst-32394	433	4	14(15	14(15	NUM
ajst-32394	433	5	)	)	PUNCT
ajst-32394	433	6	,	,	PUNCT
ajst-32394	433	7	10567–10578	10567–10578	NUM
ajst-32394	433	8	.	.	PUNCT
ajst-32394	434	1	[	[	X
ajst-32394	434	2	73	73	NUM
ajst-32394	434	3	]	]	PUNCT
ajst-32394	434	4	ajisafe	ajisafe	NOUN
ajst-32394	434	5	,	,	PUNCT
ajst-32394	434	6	o.	o.	NOUN
ajst-32394	434	7	m.	m.	NOUN
ajst-32394	434	8	,	,	PUNCT
ajst-32394	434	9	adekunle	adekunle	NOUN
ajst-32394	434	10	,	,	PUNCT
ajst-32394	434	11	y.	y.	NOUN
ajst-32394	434	12	a.	a.	PROPN
ajst-32394	434	13	,	,	PUNCT
ajst-32394	434	14	egbon	egbon	NOUN
ajst-32394	434	15	,	,	PUNCT
ajst-32394	434	16	e.	e.	PROPN
ajst-32394	434	17	,	,	PUNCT
ajst-32394	434	18	et	et	PROPN
ajst-32394	434	19	al	al	PROPN
ajst-32394	434	20	.	.	PROPN
ajst-32394	434	21	(	(	PUNCT
ajst-32394	434	22	2025	2025	NUM
ajst-32394	434	23	)	)	PUNCT
ajst-32394	434	24	.	.	PUNCT
ajst-32394	435	1	the	the	DET
ajst-32394	435	2	role	role	NOUN
ajst-32394	435	3	of	of	ADP
ajst-32394	435	4	machine	machine	NOUN
ajst-32394	435	5	learning	learn	VERB
ajst-32394	435	6	in	in	ADP
ajst-32394	435	7	predictive	predictive	ADJ
ajst-32394	435	8	toxicology	toxicology	NOUN
ajst-32394	435	9	:	:	PUNCT
ajst-32394	435	10	a	a	DET
ajst-32394	435	11	review	review	NOUN
ajst-32394	435	12	of	of	ADP
ajst-32394	435	13	current	current	ADJ
ajst-32394	435	14	trends	trend	NOUN
ajst-32394	435	15	and	and	CCONJ
ajst-32394	435	16	future	future	ADJ
ajst-32394	435	17	perspectives	perspective	NOUN
ajst-32394	435	18	.	.	PUNCT
ajst-32394	436	1	journal	journal	NOUN
ajst-32394	436	2	of	of	ADP
ajst-32394	436	3	molecular	molecular	ADJ
ajst-32394	436	4	structure	structure	NOUN
ajst-32394	436	5	,	,	PUNCT
ajst-32394	436	6	1348	1348	NUM
ajst-32394	436	7	,	,	PUNCT
ajst-32394	436	8	143449	143449	NUM
ajst-32394	436	9	.	.	PUNCT
ajst-32394	437	1	[	[	X
ajst-32394	437	2	74	74	NUM
ajst-32394	437	3	]	]	X
ajst-32394	437	4	zhao	zhao	PROPN
ajst-32394	437	5	,	,	PUNCT
ajst-32394	437	6	l.	l.	PROPN
ajst-32394	437	7	,	,	PUNCT
ajst-32394	437	8	huang	huang	PROPN
ajst-32394	437	9	,	,	PUNCT
ajst-32394	437	10	y.	y.	PROPN
ajst-32394	437	11	,	,	PUNCT
ajst-32394	437	12	li	li	PROPN
ajst-32394	437	13	,	,	PUNCT
ajst-32394	437	14	j.	j.	PROPN
ajst-32394	437	15	,	,	PUNCT
ajst-32394	437	16	&	&	CCONJ
ajst-32394	437	17	zhang	zhang	PROPN
ajst-32394	437	18	,	,	PUNCT
ajst-32394	437	19	q.	q.	PROPN
ajst-32394	437	20	(	(	PUNCT
ajst-32394	437	21	2025	2025	NUM
ajst-32394	437	22	)	)	PUNCT
ajst-32394	437	23	.	.	PUNCT
ajst-32394	438	1	explainable	explainable	ADJ
ajst-32394	438	2	ai	ai	VERB
ajst-32394	438	3	for	for	ADP
ajst-32394	438	4	toxicological	toxicological	ADJ
ajst-32394	438	5	risk	risk	NOUN
ajst-32394	438	6	assessment	assessment	NOUN
ajst-32394	438	7	:	:	PUNCT
ajst-32394	438	8	current	current	ADJ
ajst-32394	438	9	status	status	NOUN
ajst-32394	438	10	and	and	CCONJ
ajst-32394	438	11	future	future	ADJ
ajst-32394	438	12	directions	direction	NOUN
ajst-32394	438	13	.	.	PUNCT
ajst-32394	439	1	computational	computational	ADJ
ajst-32394	439	2	toxicology	toxicology	NOUN
ajst-32394	439	3	,	,	PUNCT
ajst-32394	439	4	24	24	NUM
ajst-32394	439	5	,	,	PUNCT
ajst-32394	439	6	100245	100245	NUM
ajst-32394	439	7	.	.	PUNCT
ajst-32394	440	1	[	[	X
ajst-32394	440	2	75	75	NUM
ajst-32394	440	3	]	]	X
ajst-32394	440	4	zhao	zhao	PROPN
ajst-32394	440	5	,	,	PUNCT
ajst-32394	440	6	l.	l.	PROPN
ajst-32394	440	7	,	,	PUNCT
ajst-32394	440	8	li	li	PROPN
ajst-32394	440	9	,	,	PUNCT
ajst-32394	440	10	j.	j.	PROPN
ajst-32394	440	11	,	,	PUNCT
ajst-32394	440	12	zhang	zhang	PROPN
ajst-32394	440	13	,	,	PUNCT
ajst-32394	440	14	q.	q.	PROPN
ajst-32394	440	15	,	,	PUNCT
ajst-32394	440	16	&	&	CCONJ
ajst-32394	440	17	huang	huang	PROPN
ajst-32394	440	18	,	,	PUNCT
ajst-32394	440	19	y.	y.	PROPN
ajst-32394	440	20	(	(	PUNCT
ajst-32394	440	21	2025	2025	NUM
ajst-32394	440	22	)	)	PUNCT
ajst-32394	440	23	.	.	PUNCT
ajst-32394	441	1	shap	shap	PROPN
ajst-32394	441	2	analysis	analysis	NOUN
ajst-32394	441	3	for	for	ADP
ajst-32394	441	4	risk	risk	NOUN
ajst-32394	441	5	stratification	stratification	NOUN
ajst-32394	441	6	in	in	ADP
ajst-32394	441	7	pancreatic	pancreatic	ADJ
ajst-32394	441	8	cancer	cancer	NOUN
ajst-32394	441	9	heterogeneity	heterogeneity	NOUN
ajst-32394	441	10	.	.	PUNCT
ajst-32394	442	1	discover	discover	VERB
ajst-32394	442	2	oncology	oncology	NOUN
ajst-32394	442	3	,	,	PUNCT
ajst-32394	442	4	16	16	NUM
ajst-32394	442	5	,	,	PUNCT
ajst-32394	442	6	123	123	NUM
ajst-32394	442	7	.	.	PUNCT
ajst-32394	443	1	[	[	X
ajst-32394	443	2	76	76	NUM
ajst-32394	443	3	]	]	X
ajst-32394	443	4	jin	jin	NOUN
ajst-32394	443	5	,	,	PUNCT
ajst-32394	443	6	y.	y.	PROPN
ajst-32394	443	7	,	,	PUNCT
ajst-32394	443	8	shou	shou	PROPN
ajst-32394	443	9	,	,	PUNCT
ajst-32394	443	10	y.	y.	PROPN
ajst-32394	443	11	,	,	PUNCT
ajst-32394	443	12	lei	lei	PROPN
ajst-32394	443	13	,	,	PUNCT
ajst-32394	443	14	q.	q.	PROPN
ajst-32394	443	15	,	,	PUNCT
ajst-32394	443	16	et	et	PROPN
ajst-32394	443	17	al	al	PROPN
ajst-32394	443	18	.	.	PROPN
ajst-32394	443	19	(	(	PUNCT
ajst-32394	443	20	2023	2023	NUM
ajst-32394	443	21	)	)	PUNCT
ajst-32394	443	22	.	.	PUNCT
ajst-32394	444	1	entropy	entropy	PROPN
ajst-32394	444	2	-	-	PUNCT
ajst-32394	444	3	weighted	weight	VERB
ajst-32394	444	4	multi	multi	ADJ
ajst-32394	444	5	-	-	ADJ
ajst-32394	444	6	omics	omics	ADJ
ajst-32394	444	7	integration	integration	NOUN
ajst-32394	444	8	for	for	ADP
ajst-32394	444	9	dili	dili	PROPN
ajst-32394	444	10	prediction	prediction	NOUN
ajst-32394	444	11	.	.	PUNCT
ajst-32394	445	1	hepatology	hepatology	NOUN
ajst-32394	445	2	,	,	PUNCT
ajst-32394	445	3	78(4	78(4	NUM
ajst-32394	445	4	)	)	PUNCT
ajst-32394	445	5	,	,	PUNCT
ajst-32394	445	6	1234–1245	1234–1245	NUM
ajst-32394	445	7	.	.	PUNCT
ajst-32394	446	1	[	[	X
ajst-32394	446	2	77	77	NUM
ajst-32394	446	3	]	]	X
ajst-32394	446	4	rusyn	rusyn	NOUN
ajst-32394	446	5	,	,	PUNCT
ajst-32394	446	6	i.	i.	PROPN
ajst-32394	446	7	,	,	PUNCT
ajst-32394	446	8	sedykh	sedykh	ADJ
ajst-32394	446	9	,	,	PUNCT
ajst-32394	446	10	a.	a.	NOUN
ajst-32394	446	11	,	,	PUNCT
ajst-32394	446	12	low	low	ADJ
ajst-32394	446	13	,	,	PUNCT
ajst-32394	446	14	y.	y.	PROPN
ajst-32394	446	15	,	,	PUNCT
ajst-32394	446	16	guyton	guyton	PROPN
ajst-32394	446	17	,	,	PUNCT
ajst-32394	446	18	k.	k.	PROPN
ajst-32394	446	19	z.	z.	PROPN
ajst-32394	446	20	,	,	PUNCT
ajst-32394	446	21	&	&	CCONJ
ajst-32394	446	22	tropsha	tropsha	PROPN
ajst-32394	446	23	,	,	PUNCT
ajst-32394	446	24	a.	a.	NOUN
ajst-32394	446	25	(	(	PUNCT
ajst-32394	446	26	2012	2012	NUM
ajst-32394	446	27	)	)	PUNCT
ajst-32394	446	28	.	.	PUNCT
ajst-32394	447	1	predictive	predictive	ADJ
ajst-32394	447	2	modeling	modeling	NOUN
ajst-32394	447	3	of	of	ADP
ajst-32394	447	4	chemical	chemical	ADJ
ajst-32394	447	5	hazard	hazard	NOUN
ajst-32394	447	6	by	by	ADP
ajst-32394	447	7	integrating	integrate	VERB
ajst-32394	447	8	numerical	numerical	ADJ
ajst-32394	447	9	descriptors	descriptor	NOUN
ajst-32394	447	10	of	of	ADP
ajst-32394	447	11	chemical	chemical	NOUN
ajst-32394	447	12	structures	structure	NOUN
ajst-32394	447	13	and	and	CCONJ
ajst-32394	447	14	short	short	ADJ
ajst-32394	447	15	-	-	PUNCT
ajst-32394	447	16	term	term	NOUN
ajst-32394	447	17	toxicity	toxicity	NOUN
ajst-32394	447	18	assay	assay	NOUN
ajst-32394	447	19	data	datum	NOUN
ajst-32394	447	20	.	.	PUNCT
ajst-32394	448	1	toxicological	toxicological	ADJ
ajst-32394	448	2	sciences	science	NOUN
ajst-32394	448	3	,	,	PUNCT
ajst-32394	448	4	127(1	127(1	NUM
ajst-32394	448	5	)	)	PUNCT
ajst-32394	448	6	,	,	PUNCT
ajst-32394	448	7	1–9	1–9	NOUN
ajst-32394	448	8	.	.	PUNCT