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Application
Discovery Studio
0.4916165770325846
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.10227272727272728
Amorphous Cell
0.20118801652892562
Blends
0.005165289256198347
CASTEP
0.5529442148760331
CDOCKER
0.11854338842975207
CHARMm
0.1890495867768595
COMPASS
0.428202479338843
COMPASS III
0.03744834710743802
COSMObase
0.0033574380165289257
COSMOconf
0.005423553719008265
COSMOmic
0.0010330578512396695
COSMOperm
0.0015495867768595042
COSMOplex
5.165289256198347E-4
COSMOquick
0.004132231404958678
COSMOtherm
0.15495867768595042
Catalyst
0.14927685950413222
Classical Simulations
1.0
Conformers
0.0030991735537190084
Crystallization
0.09323347107438017
DFTB Plus
0.012913223140495868
DMol3
0.4003099173553719
DPD
0.008264462809917356
Discover
0.03538223140495868
Forcite
0.4744318181818182
GULP
0.06172520661157025
Kinetix
2.5826446280991736E-4
LUDI
0.012913223140495868
LibDock
0.04442148760330578
LigandFit
0.018336776859504134
MCSS
0.0025826446280991736
MODELER
0.1443698347107438
MesoDyn
0.0015495867768595042
Mesocite
0.004390495867768595
Mesoscale
0.012138429752066115
Morphology
0.014979338842975207
ONETEP
0.007747933884297521
Polymorph
0.006198347107438017
QMERA
0.0
QSAR
0.005165289256198347
Quantum Mechanics
0.93724173553719
Reflex
0.0699896694214876
Reflex Plus
0.002840909090909091
Semi-empirical
0.023760330578512397
Sorption
0.04054752066115702
Synthia
0.0023243801652892563
TURBOMOLE
0.002840909090909091
VAMP
0.010072314049586776
Visualization
0.5769628099173554
X-Cell
0.002066115702479339
ZDOCK
0.01084710743801653
Year
2006
0.0
2007
0.046135410425404436
2008
0.05991611743559017
2009
0.06470940683043738
2010
0.08448172558418214
2011
0.12103055721989216
2012
0.14679448771719592
2013
0.15757938885560216
2014
0.17974835230677053
2015
0.1983223487118035
2016
0.21030557219892151
2017
0.21150389454763333
2018
0.29179149191132414
2019
0.32654284002396644
2020
0.4056321150389455
2021
0.4505692031156381
2022
0.6446974236069503
2023
0.8723786698621929
2024
1.0
2025
0.8909526662672259
2026
0.3732774116237268
Keywords
chemical
1.0
target
0.9550448543493599
between
0.19655276685817963
potential
0.1659106944864429
experimental
0.1443402882773914
analysis
0.12256828948694688
energy
0.11692369720794275
visualization
0.09313577260356819
docking
0.09162382824312065
novel
0.0721701441386957
surface
0.05039814534825118
well
0.04878540469710715
adsorption
0.03648825723213386
interaction
0.03628666465074085
including
0.027214998488055638
synthesized
0.021066424755568997
binding
0.01995766555790747
performance
0.012196351174276787
activity
0.007458925511541176
mechanism
0.0071565366394516685
cell
0.006350166313879649
synthesis
0.00554379598830763
promising
0.004535833081342607
stability
0.003628666465074085
effective
0.0
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