id	sid	tid	token	lemma	pos
kk91fj25g3m	1	1	the	the	DET
kk91fj25g3m	1	2	understanding	understanding	NOUN
kk91fj25g3m	1	3	of	of	ADP
kk91fj25g3m	1	4	atomic	atomic	ADJ
kk91fj25g3m	1	5	scale	scale	NOUN
kk91fj25g3m	1	6	biomolecular	biomolecular	ADJ
kk91fj25g3m	1	7	function	function	NOUN
kk91fj25g3m	1	8	is	be	AUX
kk91fj25g3m	1	9	a	a	DET
kk91fj25g3m	1	10	key	key	ADJ
kk91fj25g3m	1	11	component	component	NOUN
kk91fj25g3m	1	12	in	in	ADP
kk91fj25g3m	1	13	the	the	DET
kk91fj25g3m	1	14	prevention	prevention	NOUN
kk91fj25g3m	1	15	and	and	CCONJ
kk91fj25g3m	1	16	treatment	treatment	NOUN
kk91fj25g3m	1	17	of	of	ADP
kk91fj25g3m	1	18	disease	disease	NOUN
kk91fj25g3m	1	19	.	.	PUNCT
kk91fj25g3m	2	1	computational	computational	ADJ
kk91fj25g3m	2	2	biophysics	biophysic	NOUN
kk91fj25g3m	2	3	has	have	AUX
kk91fj25g3m	2	4	proven	prove	VERB
kk91fj25g3m	2	5	essential	essential	ADJ
kk91fj25g3m	2	6	in	in	ADP
kk91fj25g3m	2	7	this	this	DET
kk91fj25g3m	2	8	regard	regard	NOUN
kk91fj25g3m	2	9	,	,	PUNCT
kk91fj25g3m	2	10	accelerating	accelerate	VERB
kk91fj25g3m	2	11	the	the	DET
kk91fj25g3m	2	12	development	development	NOUN
kk91fj25g3m	2	13	and	and	CCONJ
kk91fj25g3m	2	14	analysis	analysis	NOUN
kk91fj25g3m	2	15	of	of	ADP
kk91fj25g3m	2	16	new	new	ADJ
kk91fj25g3m	2	17	biomolecular	biomolecular	ADJ
kk91fj25g3m	2	18	theories	theory	NOUN
kk91fj25g3m	2	19	.	.	PUNCT
kk91fj25g3m	3	1	the	the	DET
kk91fj25g3m	3	2	effective	effective	ADJ
kk91fj25g3m	3	3	contribution	contribution	NOUN
kk91fj25g3m	3	4	of	of	ADP
kk91fj25g3m	3	5	biophysical	biophysical	ADJ
kk91fj25g3m	3	6	simulation	simulation	NOUN
kk91fj25g3m	3	7	is	be	AUX
kk91fj25g3m	3	8	limited	limit	VERB
kk91fj25g3m	3	9	by	by	ADP
kk91fj25g3m	3	10	the	the	DET
kk91fj25g3m	3	11	computational	computational	ADJ
kk91fj25g3m	3	12	complexity	complexity	NOUN
kk91fj25g3m	3	13	of	of	ADP
kk91fj25g3m	3	14	the	the	DET
kk91fj25g3m	3	15	existing	exist	VERB
kk91fj25g3m	3	16	models	model	NOUN
kk91fj25g3m	3	17	.	.	PUNCT
kk91fj25g3m	4	1	in	in	ADP
kk91fj25g3m	4	2	this	this	DET
kk91fj25g3m	4	3	work	work	NOUN
kk91fj25g3m	4	4	new	new	ADJ
kk91fj25g3m	4	5	computationally	computationally	ADV
kk91fj25g3m	4	6	efficient	efficient	ADJ
kk91fj25g3m	4	7	parallel	parallel	ADJ
kk91fj25g3m	4	8	algorithms	algorithm	NOUN
kk91fj25g3m	4	9	and	and	CCONJ
kk91fj25g3m	4	10	distributed	distribute	VERB
kk91fj25g3m	4	11	system	system	NOUN
kk91fj25g3m	4	12	frameworks	framework	NOUN
kk91fj25g3m	4	13	are	be	AUX
kk91fj25g3m	4	14	developed	develop	VERB
kk91fj25g3m	4	15	to	to	PART
kk91fj25g3m	4	16	extend	extend	VERB
kk91fj25g3m	4	17	the	the	DET
kk91fj25g3m	4	18	capability	capability	NOUN
kk91fj25g3m	4	19	of	of	ADP
kk91fj25g3m	4	20	biophysical	biophysical	ADJ
kk91fj25g3m	4	21	simulation	simulation	NOUN
kk91fj25g3m	4	22	.	.	PUNCT
kk91fj25g3m	5	1	in	in	ADP
kk91fj25g3m	5	2	tandem	tandem	PROPN
kk91fj25g3m	5	3	to	to	ADP
kk91fj25g3m	5	4	this	this	DET
kk91fj25g3m	5	5	development	development	NOUN
kk91fj25g3m	5	6	,	,	PUNCT
kk91fj25g3m	5	7	i	i	PRON
kk91fj25g3m	5	8	present	present	VERB
kk91fj25g3m	5	9	the	the	DET
kk91fj25g3m	5	10	simulation	simulation	NOUN
kk91fj25g3m	5	11	and	and	CCONJ
kk91fj25g3m	5	12	analysis	analysis	NOUN
kk91fj25g3m	5	13	of	of	ADP
kk91fj25g3m	5	14	a	a	DET
kk91fj25g3m	5	15	target	target	NOUN
kk91fj25g3m	5	16	protein	protein	NOUN
kk91fj25g3m	5	17	domain	domain	NOUN
kk91fj25g3m	5	18	linked	link	VERB
kk91fj25g3m	5	19	to	to	ADP
kk91fj25g3m	5	20	cancer	cancer	NOUN
kk91fj25g3m	5	21	,	,	PUNCT
kk91fj25g3m	5	22	huntington	huntington	PROPN
kk91fj25g3m	5	23	disease	disease	PROPN
kk91fj25g3m	5	24	,	,	PUNCT
kk91fj25g3m	5	25	and	and	CCONJ
kk91fj25g3m	5	26	alzheimer	alzheimer	NOUN
kk91fj25g3m	5	27	disease	disease	NOUN
kk91fj25g3m	5	28	.	.	PUNCT
kk91fj25g3m	6	1	the	the	DET
kk91fj25g3m	6	2	replica	replica	PROPN
kk91fj25g3m	6	3	exchange	exchange	PROPN
kk91fj25g3m	6	4	method	method	NOUN
kk91fj25g3m	6	5	is	be	AUX
kk91fj25g3m	6	6	a	a	DET
kk91fj25g3m	6	7	popular	popular	ADJ
kk91fj25g3m	6	8	biomolecular	biomolecular	ADJ
kk91fj25g3m	6	9	sampling	sampling	NOUN
kk91fj25g3m	6	10	algorithm	algorithm	NOUN
kk91fj25g3m	6	11	that	that	PRON
kk91fj25g3m	6	12	utilizes	utilize	VERB
kk91fj25g3m	6	13	multiple	multiple	ADJ
kk91fj25g3m	6	14	simulations	simulation	NOUN
kk91fj25g3m	6	15	(	(	PUNCT
kk91fj25g3m	6	16	replicas	replica	NOUN
kk91fj25g3m	6	17	)	)	PUNCT
kk91fj25g3m	6	18	,	,	PUNCT
kk91fj25g3m	6	19	to	to	PART
kk91fj25g3m	6	20	more	more	ADV
kk91fj25g3m	6	21	rapidly	rapidly	ADV
kk91fj25g3m	6	22	overcome	overcome	VERB
kk91fj25g3m	6	23	energy	energy	NOUN
kk91fj25g3m	6	24	landscape	landscape	NOUN
kk91fj25g3m	6	25	boundaries	boundary	NOUN
kk91fj25g3m	6	26	and	and	CCONJ
kk91fj25g3m	6	27	accelerate	accelerate	VERB
kk91fj25g3m	6	28	sampling	sampling	NOUN
kk91fj25g3m	6	29	.	.	PUNCT
kk91fj25g3m	7	1	the	the	DET
kk91fj25g3m	7	2	method	method	NOUN
kk91fj25g3m	7	3	has	have	VERB
kk91fj25g3m	7	4	limitations	limitation	NOUN
kk91fj25g3m	7	5	in	in	ADP
kk91fj25g3m	7	6	scale	scale	NOUN
kk91fj25g3m	7	7	related	relate	VERB
kk91fj25g3m	7	8	to	to	ADP
kk91fj25g3m	7	9	the	the	DET
kk91fj25g3m	7	10	size	size	NOUN
kk91fj25g3m	7	11	of	of	ADP
kk91fj25g3m	7	12	the	the	DET
kk91fj25g3m	7	13	biomolecular	biomolecular	ADJ
kk91fj25g3m	7	14	system	system	NOUN
kk91fj25g3m	7	15	and	and	CCONJ
kk91fj25g3m	7	16	required	require	VERB
kk91fj25g3m	7	17	number	number	NOUN
kk91fj25g3m	7	18	of	of	ADP
kk91fj25g3m	7	19	replicas	replica	NOUN
kk91fj25g3m	7	20	.	.	PUNCT
kk91fj25g3m	8	1	i	i	PRON
kk91fj25g3m	8	2	introduce	introduce	VERB
kk91fj25g3m	8	3	a	a	DET
kk91fj25g3m	8	4	novel	novel	NOUN
kk91fj25g3m	8	5	all	all	DET
kk91fj25g3m	8	6	pairs	pair	NOUN
kk91fj25g3m	8	7	exchange	exchange	NOUN
kk91fj25g3m	8	8	implementation	implementation	NOUN
kk91fj25g3m	8	9	of	of	ADP
kk91fj25g3m	8	10	the	the	DET
kk91fj25g3m	8	11	algorithm	algorithm	NOUN
kk91fj25g3m	8	12	that	that	PRON
kk91fj25g3m	8	13	provides	provide	VERB
kk91fj25g3m	8	14	asymptotically	asymptotically	ADV
kk91fj25g3m	8	15	four	four	NUM
kk91fj25g3m	8	16	fold	fold	ADJ
kk91fj25g3m	8	17	speedup	speedup	NOUN
kk91fj25g3m	8	18	of	of	ADP
kk91fj25g3m	8	19	conformation	conformation	NOUN
kk91fj25g3m	8	20	traversal	traversal	NOUN
kk91fj25g3m	8	21	for	for	ADP
kk91fj25g3m	8	22	replica	replica	NOUN
kk91fj25g3m	8	23	counts	count	NOUN
kk91fj25g3m	8	24	of	of	ADP
kk91fj25g3m	8	25	8	8	NUM
kk91fj25g3m	8	26	and	and	CCONJ
kk91fj25g3m	8	27	larger	large	ADJ
kk91fj25g3m	8	28	with	with	ADP
kk91fj25g3m	8	29	typical	typical	ADJ
kk91fj25g3m	8	30	exchange	exchange	NOUN
kk91fj25g3m	8	31	rates	rate	NOUN
kk91fj25g3m	8	32	.	.	PUNCT
kk91fj25g3m	9	1	experimental	experimental	ADJ
kk91fj25g3m	9	2	tests	test	NOUN
kk91fj25g3m	9	3	with	with	ADP
kk91fj25g3m	9	4	the	the	DET
kk91fj25g3m	9	5	blocked	block	VERB
kk91fj25g3m	9	6	alanine	alanine	NOUN
kk91fj25g3m	9	7	dipeptide	dipeptide	NOUN
kk91fj25g3m	9	8	show	show	VERB
kk91fj25g3m	9	9	a	a	DET
kk91fj25g3m	9	10	100	100	NUM
kk91fj25g3m	9	11	%	%	NOUN
kk91fj25g3m	9	12	sampling	sampling	NOUN
kk91fj25g3m	9	13	improvement	improvement	NOUN
kk91fj25g3m	9	14	according	accord	VERB
kk91fj25g3m	9	15	to	to	ADP
kk91fj25g3m	9	16	potential	potential	ADJ
kk91fj25g3m	9	17	energy	energy	NOUN
kk91fj25g3m	9	18	averages	average	NOUN
kk91fj25g3m	9	19	and	and	CCONJ
kk91fj25g3m	9	20	an	an	DET
kk91fj25g3m	9	21	ergodic	ergodic	ADJ
kk91fj25g3m	9	22	measure	measure	NOUN
kk91fj25g3m	9	23	.	.	PUNCT
kk91fj25g3m	10	1	the	the	DET
kk91fj25g3m	10	2	cluster	cluster	NOUN
kk91fj25g3m	10	3	sampling	sample	VERB
kk91fj25g3m	10	4	rate	rate	NOUN
kk91fj25g3m	10	5	for	for	ADP
kk91fj25g3m	10	6	a	a	DET
kk91fj25g3m	10	7	target	target	NOUN
kk91fj25g3m	10	8	protein	protein	NOUN
kk91fj25g3m	10	9	domain	domain	NOUN
kk91fj25g3m	10	10	was	be	AUX
kk91fj25g3m	10	11	nearly	nearly	ADV
kk91fj25g3m	10	12	twice	twice	DET
kk91fj25g3m	10	13	that	that	PRON
kk91fj25g3m	10	14	of	of	ADP
kk91fj25g3m	10	15	the	the	DET
kk91fj25g3m	10	16	single	single	ADJ
kk91fj25g3m	10	17	exchange	exchange	NOUN
kk91fj25g3m	10	18	near	near	ADP
kk91fj25g3m	10	19	neighbor	neighbor	NOUN
kk91fj25g3m	10	20	method	method	NOUN
kk91fj25g3m	10	21	.	.	PUNCT
kk91fj25g3m	11	1	the	the	DET
kk91fj25g3m	11	2	method	method	NOUN
kk91fj25g3m	11	3	meets	meet	VERB
kk91fj25g3m	11	4	the	the	DET
kk91fj25g3m	11	5	detailed	detailed	ADJ
kk91fj25g3m	11	6	balance	balance	NOUN
kk91fj25g3m	11	7	criterion	criterion	NOUN
kk91fj25g3m	11	8	for	for	ADP
kk91fj25g3m	11	9	monte	monte	PROPN
kk91fj25g3m	11	10	carlo	carlo	PROPN
kk91fj25g3m	11	11	methods	method	NOUN
kk91fj25g3m	11	12	and	and	CCONJ
kk91fj25g3m	11	13	introduces	introduce	VERB
kk91fj25g3m	11	14	no	no	DET
kk91fj25g3m	11	15	new	new	ADJ
kk91fj25g3m	11	16	parameterizations	parameterization	NOUN
kk91fj25g3m	11	17	,	,	PUNCT
kk91fj25g3m	11	18	biases	bias	NOUN
kk91fj25g3m	11	19	,	,	PUNCT
kk91fj25g3m	11	20	or	or	CCONJ
kk91fj25g3m	11	21	heuristics	heuristic	NOUN
kk91fj25g3m	11	22	.	.	PUNCT
kk91fj25g3m	12	1	the	the	DET
kk91fj25g3m	12	2	development	development	NOUN
kk91fj25g3m	12	3	of	of	ADP
kk91fj25g3m	12	4	distributed	distribute	VERB
kk91fj25g3m	12	5	systems	system	NOUN
kk91fj25g3m	12	6	for	for	ADP
kk91fj25g3m	12	7	scientific	scientific	ADJ
kk91fj25g3m	12	8	computation	computation	NOUN
kk91fj25g3m	12	9	is	be	AUX
kk91fj25g3m	12	10	an	an	DET
kk91fj25g3m	12	11	active	active	ADJ
kk91fj25g3m	12	12	research	research	NOUN
kk91fj25g3m	12	13	field	field	NOUN
kk91fj25g3m	12	14	propelled	propel	VERB
kk91fj25g3m	12	15	by	by	ADP
kk91fj25g3m	12	16	the	the	DET
kk91fj25g3m	12	17	growing	grow	VERB
kk91fj25g3m	12	18	number	number	NOUN
kk91fj25g3m	12	19	of	of	ADP
kk91fj25g3m	12	20	research	research	NOUN
kk91fj25g3m	12	21	projects	project	NOUN
kk91fj25g3m	12	22	relying	rely	VERB
kk91fj25g3m	12	23	on	on	ADP
kk91fj25g3m	12	24	computationally	computationally	ADV
kk91fj25g3m	12	25	complex	complex	ADJ
kk91fj25g3m	12	26	simulations	simulation	NOUN
kk91fj25g3m	12	27	as	as	ADP
kk91fj25g3m	12	28	part	part	NOUN
kk91fj25g3m	12	29	of	of	ADP
kk91fj25g3m	12	30	the	the	DET
kk91fj25g3m	12	31	discovery	discovery	NOUN
kk91fj25g3m	12	32	process	process	NOUN
kk91fj25g3m	12	33	.	.	PUNCT
kk91fj25g3m	13	1	many	many	ADJ
kk91fj25g3m	13	2	proposed	propose	VERB
kk91fj25g3m	13	3	frameworks	framework	NOUN
kk91fj25g3m	13	4	have	have	AUX
kk91fj25g3m	13	5	been	be	AUX
kk91fj25g3m	13	6	successfully	successfully	ADV
kk91fj25g3m	13	7	matched	match	VERB
kk91fj25g3m	13	8	with	with	ADP
kk91fj25g3m	13	9	unique	unique	ADJ
kk91fj25g3m	13	10	applications	application	NOUN
kk91fj25g3m	13	11	to	to	PART
kk91fj25g3m	13	12	provide	provide	VERB
kk91fj25g3m	13	13	the	the	DET
kk91fj25g3m	13	14	computational	computational	ADJ
kk91fj25g3m	13	15	capacity	capacity	NOUN
kk91fj25g3m	13	16	required	require	VERB
kk91fj25g3m	13	17	.	.	PUNCT
kk91fj25g3m	14	1	only	only	ADV
kk91fj25g3m	14	2	recently	recently	ADV
kk91fj25g3m	14	3	,	,	PUNCT
kk91fj25g3m	14	4	has	have	AUX
kk91fj25g3m	14	5	more	more	ADJ
kk91fj25g3m	14	6	focus	focus	NOUN
kk91fj25g3m	14	7	been	be	AUX
kk91fj25g3m	14	8	targeted	target	VERB
kk91fj25g3m	14	9	toward	toward	ADP
kk91fj25g3m	14	10	the	the	DET
kk91fj25g3m	14	11	efficient	efficient	ADJ
kk91fj25g3m	14	12	management	management	NOUN
kk91fj25g3m	14	13	of	of	ADP
kk91fj25g3m	14	14	the	the	DET
kk91fj25g3m	14	15	distributed	distribute	VERB
kk91fj25g3m	14	16	data	datum	NOUN
kk91fj25g3m	14	17	.	.	PUNCT
kk91fj25g3m	15	1	i	i	PRON
kk91fj25g3m	15	2	introduce	introduce	VERB
kk91fj25g3m	15	3	a	a	DET
kk91fj25g3m	15	4	'	'	PUNCT
kk91fj25g3m	15	5	processing	processing	NOUN
kk91fj25g3m	15	6	in	in	ADP
kk91fj25g3m	15	7	network	network	NOUN
kk91fj25g3m	15	8	storage	storage	NOUN
kk91fj25g3m	15	9	'	'	PUNCT
kk91fj25g3m	15	10	distributed	distribute	VERB
kk91fj25g3m	15	11	system	system	NOUN
kk91fj25g3m	15	12	framework	framework	NOUN
kk91fj25g3m	15	13	that	that	PRON
kk91fj25g3m	15	14	efficiently	efficiently	ADV
kk91fj25g3m	15	15	couples	couple	VERB
kk91fj25g3m	15	16	computation	computation	VERB
kk91fj25g3m	15	17	with	with	ADP
kk91fj25g3m	15	18	data	data	NOUN
kk91fj25g3m	15	19	management	management	NOUN
kk91fj25g3m	15	20	over	over	ADP
kk91fj25g3m	15	21	heterogeneous	heterogeneous	ADJ
kk91fj25g3m	15	22	,	,	PUNCT
kk91fj25g3m	15	23	autonomous	autonomous	ADJ
kk91fj25g3m	15	24	,	,	PUNCT
kk91fj25g3m	15	25	and	and	CCONJ
kk91fj25g3m	15	26	distributed	distribute	VERB
kk91fj25g3m	15	27	resources	resource	NOUN
kk91fj25g3m	15	28	.	.	PUNCT
kk91fj25g3m	16	1	the	the	DET
kk91fj25g3m	16	2	framework	framework	NOUN
kk91fj25g3m	16	3	provides	provide	VERB
kk91fj25g3m	16	4	a	a	DET
kk91fj25g3m	16	5	fault	fault	NOUN
kk91fj25g3m	16	6	tolerant	tolerant	ADJ
kk91fj25g3m	16	7	,	,	PUNCT
kk91fj25g3m	16	8	scalable	scalable	ADJ
kk91fj25g3m	16	9	,	,	PUNCT
kk91fj25g3m	16	10	and	and	CCONJ
kk91fj25g3m	16	11	bandwidth	bandwidth	ADJ
kk91fj25g3m	16	12	conserving	conserve	VERB
kk91fj25g3m	16	13	approach	approach	NOUN
kk91fj25g3m	16	14	through	through	ADP
kk91fj25g3m	16	15	the	the	DET
kk91fj25g3m	16	16	utilization	utilization	NOUN
kk91fj25g3m	16	17	of	of	ADP
kk91fj25g3m	16	18	existing	exist	VERB
kk91fj25g3m	16	19	grid	grid	NOUN
kk91fj25g3m	16	20	software	software	NOUN
kk91fj25g3m	16	21	utilities	utility	NOUN
kk91fj25g3m	16	22	and	and	CCONJ
kk91fj25g3m	16	23	a	a	DET
kk91fj25g3m	16	24	new	new	ADJ
kk91fj25g3m	16	25	hybrid	hybrid	ADJ
kk91fj25g3m	16	26	database	database	NOUN
kk91fj25g3m	16	27	/	/	SYM
kk91fj25g3m	16	28	filesystem	filesystem	NOUN
kk91fj25g3m	16	29	developed	develop	VERB
kk91fj25g3m	16	30	with	with	ADP
kk91fj25g3m	16	31	our	our	PRON
kk91fj25g3m	16	32	collaborators	collaborator	NOUN
kk91fj25g3m	16	33	.	.	PUNCT
kk91fj25g3m	17	1	the	the	DET
kk91fj25g3m	17	2	performance	performance	NOUN
kk91fj25g3m	17	3	is	be	AUX
kk91fj25g3m	17	4	evaluated	evaluate	VERB
kk91fj25g3m	17	5	during	during	ADP
kk91fj25g3m	17	6	the	the	DET
kk91fj25g3m	17	7	generation	generation	NOUN
kk91fj25g3m	17	8	of	of	ADP
kk91fj25g3m	17	9	500	500	NUM
kk91fj25g3m	17	10	biomolecular	biomolecular	ADJ
kk91fj25g3m	17	11	simulations	simulation	NOUN
kk91fj25g3m	17	12	producing	produce	VERB
kk91fj25g3m	17	13	over	over	ADP
kk91fj25g3m	17	14	1	1	NUM
kk91fj25g3m	17	15	million	million	NUM
kk91fj25g3m	17	16	output	output	NOUN
kk91fj25g3m	17	17	files	file	NOUN
kk91fj25g3m	17	18	distributed	distribute	VERB
kk91fj25g3m	17	19	over	over	ADP
kk91fj25g3m	17	20	volunteer	volunteer	NOUN
kk91fj25g3m	17	21	resources	resource	NOUN
kk91fj25g3m	17	22	.	.	PUNCT
kk91fj25g3m	18	1	the	the	DET
kk91fj25g3m	18	2	correlation	correlation	NOUN
kk91fj25g3m	18	3	of	of	ADP
kk91fj25g3m	18	4	atomic	atomic	ADJ
kk91fj25g3m	18	5	scale	scale	NOUN
kk91fj25g3m	18	6	simulations	simulation	NOUN
kk91fj25g3m	18	7	with	with	ADP
kk91fj25g3m	18	8	existing	exist	VERB
kk91fj25g3m	18	9	experimental	experimental	ADJ
kk91fj25g3m	18	10	techniques	technique	NOUN
kk91fj25g3m	18	11	provides	provide	VERB
kk91fj25g3m	18	12	complementary	complementary	ADJ
kk91fj25g3m	18	13	data	datum	NOUN
kk91fj25g3m	18	14	sets	set	NOUN
kk91fj25g3m	18	15	that	that	PRON
kk91fj25g3m	18	16	cross	cross	VERB
kk91fj25g3m	18	17	validate	validate	NOUN
kk91fj25g3m	18	18	and	and	CCONJ
kk91fj25g3m	18	19	more	more	ADV
kk91fj25g3m	18	20	thoroughly	thoroughly	ADV
kk91fj25g3m	18	21	map	map	VERB
kk91fj25g3m	18	22	biomolecular	biomolecular	ADJ
kk91fj25g3m	18	23	motion	motion	NOUN
kk91fj25g3m	18	24	of	of	ADP
kk91fj25g3m	18	25	interest	interest	NOUN
kk91fj25g3m	18	26	.	.	PUNCT
kk91fj25g3m	19	1	this	this	DET
kk91fj25g3m	19	2	correlation	correlation	NOUN
kk91fj25g3m	19	3	however	however	ADV
kk91fj25g3m	19	4	is	be	AUX
kk91fj25g3m	19	5	complicated	complicate	VERB
kk91fj25g3m	19	6	by	by	ADP
kk91fj25g3m	19	7	the	the	DET
kk91fj25g3m	19	8	often	often	ADV
kk91fj25g3m	19	9	disjoint	disjoint	ADJ
kk91fj25g3m	19	10	nature	nature	NOUN
kk91fj25g3m	19	11	of	of	ADP
kk91fj25g3m	19	12	the	the	DET
kk91fj25g3m	19	13	observables	observable	NOUN
kk91fj25g3m	19	14	accessible	accessible	ADJ
kk91fj25g3m	19	15	from	from	ADP
kk91fj25g3m	19	16	simulation	simulation	NOUN
kk91fj25g3m	19	17	and	and	CCONJ
kk91fj25g3m	19	18	experiment	experiment	NOUN
kk91fj25g3m	19	19	.	.	PUNCT
kk91fj25g3m	20	1	in	in	ADP
kk91fj25g3m	20	2	this	this	DET
kk91fj25g3m	20	3	work	work	NOUN
kk91fj25g3m	20	4	,	,	PUNCT
kk91fj25g3m	20	5	biophysical	biophysical	ADJ
kk91fj25g3m	20	6	simulations	simulation	NOUN
kk91fj25g3m	20	7	of	of	ADP
kk91fj25g3m	20	8	the	the	DET
kk91fj25g3m	20	9	isomerase	isomerase	NOUN
kk91fj25g3m	20	10	pin1	pin1	NOUN
kk91fj25g3m	20	11	ww	ww	PROPN
kk91fj25g3m	20	12	domain	domain	NOUN
kk91fj25g3m	20	13	reveal	reveal	VERB
kk91fj25g3m	20	14	insight	insight	NOUN
kk91fj25g3m	20	15	into	into	ADP
kk91fj25g3m	20	16	promising	promise	VERB
kk91fj25g3m	20	17	reaction	reaction	NOUN
kk91fj25g3m	20	18	coordinates	coordinate	NOUN
kk91fj25g3m	20	19	to	to	PART
kk91fj25g3m	20	20	help	help	VERB
kk91fj25g3m	20	21	map	map	VERB
kk91fj25g3m	20	22	simulation	simulation	NOUN
kk91fj25g3m	20	23	observed	observe	VERB
kk91fj25g3m	20	24	recognition	recognition	NOUN
kk91fj25g3m	20	25	loop	loop	NOUN
kk91fj25g3m	20	26	motion	motion	NOUN
kk91fj25g3m	20	27	to	to	ADP
kk91fj25g3m	20	28	experimental	experimental	ADJ
kk91fj25g3m	20	29	nuclear	nuclear	PROPN
kk91fj25g3m	20	30	magnetic	magnetic	ADJ
kk91fj25g3m	20	31	resonance	resonance	NOUN
kk91fj25g3m	20	32	(	(	PUNCT
kk91fj25g3m	20	33	nmr	nmr	NOUN
kk91fj25g3m	20	34	)	)	PUNCT
kk91fj25g3m	20	35	results	result	NOUN
kk91fj25g3m	20	36	.	.	PUNCT
kk91fj25g3m	21	1	post	post	NOUN
kk91fj25g3m	21	2	processing	process	VERB
kk91fj25g3m	21	3	analysis	analysis	NOUN
kk91fj25g3m	21	4	methods	method	NOUN
kk91fj25g3m	21	5	and	and	CCONJ
kk91fj25g3m	21	6	metrics	metric	NOUN
kk91fj25g3m	21	7	including	include	VERB
kk91fj25g3m	21	8	dihedral	dihedral	ADJ
kk91fj25g3m	21	9	distributions	distribution	NOUN
kk91fj25g3m	21	10	,	,	PUNCT
kk91fj25g3m	21	11	conformational	conformational	ADJ
kk91fj25g3m	21	12	clustering	clustering	NOUN
kk91fj25g3m	21	13	,	,	PUNCT
kk91fj25g3m	21	14	hydrogen	hydrogen	NOUN
kk91fj25g3m	21	15	bond	bond	NOUN
kk91fj25g3m	21	16	determination	determination	NOUN
kk91fj25g3m	21	17	,	,	PUNCT
kk91fj25g3m	21	18	and	and	CCONJ
kk91fj25g3m	21	19	committor	committor	ADJ
kk91fj25g3m	21	20	probability	probability	NOUN
kk91fj25g3m	21	21	calculations	calculation	NOUN
kk91fj25g3m	21	22	indicate	indicate	VERB
kk91fj25g3m	21	23	that	that	SCONJ
kk91fj25g3m	21	24	the	the	DET
kk91fj25g3m	21	25	observed	observed	ADJ
kk91fj25g3m	21	26	motion	motion	NOUN
kk91fj25g3m	21	27	of	of	ADP
kk91fj25g3m	21	28	the	the	DET
kk91fj25g3m	21	29	arginine	arginine	NOUN
kk91fj25g3m	21	30	12	12	NUM
kk91fj25g3m	21	31	residue	residue	NOUN
kk91fj25g3m	21	32	is	be	AUX
kk91fj25g3m	21	33	coupled	couple	VERB
kk91fj25g3m	21	34	to	to	ADP
kk91fj25g3m	21	35	the	the	DET
kk91fj25g3m	21	36	multivariate	multivariate	NOUN
kk91fj25g3m	21	37	conformational	conformational	ADJ
kk91fj25g3m	21	38	changes	change	NOUN
kk91fj25g3m	21	39	of	of	ADP
kk91fj25g3m	21	40	the	the	DET
kk91fj25g3m	21	41	recognition	recognition	NOUN
kk91fj25g3m	21	42	loop	loop	NOUN
kk91fj25g3m	21	43	.	.	PUNCT