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Application
Discovery Studio
0.33881199538638984
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.06537282941777324
Amorphous Cell
0.263023493360572
Blends
0.007660878447395302
CASTEP
0.6123595505617978
CDOCKER
0.08324821246169561
CHARMm
0.15781409601634322
COMPASS
0.3953013278855976
COMPASS III
0.018896833503575076
COSMObase
5.107252298263534E-4
COSMOconf
0.0020429009193054137
COSMOmic
0.0015321756894790602
COSMOperm
0.0
COSMOquick
0.0020429009193054137
COSMOtherm
0.07814096016343207
Catalyst
0.07814096016343207
Classical Simulations
0.9530132788559755
Conformers
0.0030643513789581204
Crystallization
0.09141981613891727
DFTB Plus
0.002553626149131767
DMol3
0.4065372829417773
DPD
0.008682328907048007
Discover
0.04034729315628192
Forcite
0.46629213483146065
GULP
0.07201225740551584
LUDI
0.006639427987742594
LibDock
0.0296220633299285
LigandFit
0.018896833503575076
MCSS
0.0
MODELER
0.13534218590398367
MesoDyn
0.008682328907048007
Mesocite
0.007150153217568948
Mesoscale
0.02247191011235955
Morphology
0.02247191011235955
ONETEP
0.0040858018386108275
Polymorph
0.006128702757916241
QMERA
5.107252298263534E-4
QSAR
0.0
Quantum Mechanics
1.0
Reflex
0.05975485188968335
Reflex Plus
0.003575076608784474
Semi-empirical
0.008171603677221655
Sorption
0.07711950970377937
Synthia
0.0
TURBOMOLE
0.0010214504596527069
VAMP
0.0040858018386108275
Visualization
0.398876404494382
X-Cell
0.002553626149131767
ZDOCK
0.017364657814096015
Year
2003
0.0
2004
0.017684887459807074
2005
0.03215434083601286
2006
0.03536977491961415
2007
0.05305466237942122
2008
0.08681672025723473
2009
0.10128617363344052
2010
0.12379421221864952
2011
0.12218649517684887
2012
0.19614147909967847
2013
0.2684887459807074
2014
0.35691318327974275
2015
0.3295819935691318
2016
0.37942122186495175
2017
0.43569131832797425
2018
0.4871382636655949
2019
0.5852090032154341
2020
0.4983922829581994
2021
0.41639871382636656
2022
0.905144694533762
2023
1.0
2024
0.905144694533762
2025
0.612540192926045
2026
0.012861736334405145
Keywords
higher
1.0
target
0.9580717488789238
between
0.21345291479820627
energy
0.1804932735426009
potential
0.09103139013452914
experimental
0.09058295964125561
analysis
0.07668161434977579
lower
0.05739910313901345
surface
0.049551569506726456
interaction
0.04035874439461883
cell
0.03430493273542601
well
0.033183856502242155
temperature
0.032511210762331835
visualization
0.02914798206278027
adsorption
0.0242152466367713
docking
0.01883408071748879
chemical
0.014798206278026907
novel
0.014798206278026907
stability
0.012780269058295964
activity
0.010762331838565023
synthesized
0.00874439461883408
performance
0.007174887892376682
binding
0.0053811659192825115
stable
0.004260089686098654
mechanism
0.0
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