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Application
Discovery Studio
0.401934044135879
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.03901120123599845
Amorphous Cell
0.1544998068752414
Blends
0.003089996137504828
CASTEP
0.6114329857087679
CDOCKER
0.0880648899188876
CHARMm
0.16763229045963693
COMPASS
0.28389339513325607
COMPASS III
0.003089996137504828
COSMObase
3.862495171881035E-4
COSMOconf
0.001544998068752414
COSMOmic
0.001544998068752414
COSMOperm
0.0
COSMOplex
0.0
COSMOquick
0.002317497103128621
COSMOtherm
0.09308613364233295
Catalyst
0.14677481653147934
Classical Simulations
0.7713402858246428
Conformers
0.003089996137504828
Crystallization
0.07531865585168018
DFTB Plus
0.0034762456546929316
DMol3
0.40092699884125144
DPD
0.012359984550019312
Discover
0.06064117419853225
Forcite
0.24565469293163383
GULP
0.13093858632676708
LUDI
0.014677481653147934
LibDock
0.03244495944380069
LigandFit
0.028968713789107765
MCSS
0.002317497103128621
MODELER
0.21320973348783315
MesoDyn
0.006952491309385863
Mesocite
0.005407493240633449
Mesoscale
0.0220162224797219
Morphology
0.020084974893781384
ONETEP
0.005793742757821553
Polymorph
0.005021243723445346
QMERA
0.0
QSAR
0.005021243723445346
Quantum Mechanics
1.0
Reflex
0.04828118964851294
Reflex Plus
0.004634994206257242
Semi-empirical
0.008883738895326381
Sorption
0.028196214754731556
Synthia
0.0019312475859405175
TURBOMOLE
0.002317497103128621
VAMP
0.005021243723445346
Visualization
0.3290845886442642
X-Cell
0.005407493240633449
ZDOCK
0.016994978756276556
Year
2002
0.0
2003
0.024226110363391656
2004
0.09152086137281291
2005
0.11843876177658143
2006
0.17631224764468373
2007
0.20053835800807537
2008
0.2772543741588156
2009
0.3283983849259758
2010
0.4306864064602961
2011
0.4522207267833109
2012
0.30148048452220727
2013
0.44549125168236875
2014
0.5329744279946165
2015
0.620457604306864
2016
0.6379542395693136
2017
0.5343203230148048
2018
0.2759084791386272
2019
0.3472409152086137
2020
0.5625841184387618
2021
0.3283983849259758
2022
1.0
2023
0.6218034993270525
2024
0.13728129205921938
2025
0.1009421265141319
2026
0.033647375504710635
Keywords
well
1.0
target
0.9380701754385965
between
0.21350877192982456
experimental
0.19526315789473683
energy
0.14701754385964913
potential
0.10421052631578948
chemical
0.0819298245614035
analysis
0.08140350877192983
surface
0.055614035087719296
interaction
0.04912280701754386
novel
0.04035087719298246
binding
0.037192982456140354
cell
0.034736842105263156
visualization
0.029298245614035087
docking
0.027017543859649124
applied
0.013859649122807018
role
0.011228070175438596
formation
0.009824561403508772
mechanism
0.007017543859649123
including
0.005789473684210527
temperature
0.005614035087719298
activity
0.005263157894736842
protein
0.0033333333333333335
higher
0.002105263157894737
crystal
0.0
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