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Application
Discovery Studio
0.7205542725173211
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.09724047306176084
Amorphous Cell
0.11563731931668857
Blends
0.001314060446780552
CASTEP
0.6583442838370565
CDOCKER
0.26544021024967146
CHARMm
0.290407358738502
COMPASS
0.290407358738502
COMPASS III
0.010512483574244415
COSMOquick
0.0
COSMOtherm
0.02759526938239159
Catalyst
0.35348226018396844
Classical Simulations
0.8843626806833115
Conformers
0.0
Crystallization
0.15505913272010513
DFTB Plus
0.005256241787122208
DMol3
0.36530880420499345
DPD
0.006570302233902759
Discover
0.03416557161629435
Forcite
0.33771353482260186
GULP
0.0328515111695138
LUDI
0.013140604467805518
LibDock
0.05519053876478318
LigandFit
0.040735873850197106
MCSS
0.001314060446780552
MODELER
0.16294349540078842
MesoDyn
0.001314060446780552
Mesocite
0.0
Mesoscale
0.010512483574244415
Morphology
0.013140604467805518
Polymorph
0.003942181340341655
QMERA
0.0
QSAR
0.001314060446780552
Quantum Mechanics
1.0
Reflex
0.12746386333771353
Reflex Plus
0.009198423127463863
Semi-empirical
0.018396846254927726
Sorption
0.03942181340341656
Synthia
0.0
TURBOMOLE
0.0
VAMP
0.010512483574244415
Visualization
0.5676741130091985
X-Cell
0.006570302233902759
ZDOCK
0.005256241787122208
Year
2004
0.0
2005
0.0196078431372549
2006
0.0457516339869281
2007
0.058823529411764705
2008
0.08496732026143791
2009
0.10130718954248366
2010
0.13725490196078433
2011
0.1568627450980392
2012
0.24183006535947713
2013
0.40522875816993464
2014
0.6143790849673203
2015
0.43790849673202614
2016
0.3790849673202614
2017
0.5784313725490197
2018
0.565359477124183
2019
0.5326797385620915
2020
0.38235294117647056
2021
0.3562091503267974
2022
1.0
2023
0.7058823529411765
2024
0.08823529411764706
2025
0.14705882352941177
2026
0.0392156862745098
Keywords
synthesized
1.0
target
0.9705882352941176
synthesis
0.30070993914807304
novel
0.20436105476673427
compound
0.12322515212981744
docking
0.11764705882352941
potential
0.10851926977687627
between
0.07910750507099391
activity
0.07707910750507099
designed
0.07454361054766734
analysis
0.0537525354969574
visualization
0.053245436105476676
experimental
0.04969574036511156
design
0.04310344827586207
potent
0.028397565922920892
energy
0.019269776876267748
medicinal
0.017241379310344827
x-ray
0.015720081135902637
well
0.013184584178498986
chemical
0.007606490872210953
catalyst
0.007099391480730223
inhibition
0.006085192697768763
promising
0.004563894523326572
vitro
5.070993914807302E-4
cell
0.0
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