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Application
Discovery Studio
0.6689069685178635
Materials Studio
1.0
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.0873015873015873
Amorphous Cell
0.11660561660561661
Antibody
0.0
Blends
0.002442002442002442
CASTEP
0.6428571428571429
CDOCKER
0.25213675213675213
CHARMm
0.27472527472527475
COMPASS
0.29365079365079366
COMPASS III
0.007326007326007326
COSMOconf
0.0
COSMOtherm
0.029304029304029304
Catalyst
0.2844932844932845
Classical Simulations
0.8803418803418803
Conformers
0.001221001221001221
Crystallization
0.163003663003663
DFTB Plus
0.006105006105006105
DMol3
0.3717948717948718
DPD
0.009768009768009768
Discover
0.03663003663003663
Forcite
0.3302808302808303
GULP
0.03663003663003663
LUDI
0.009157509157509158
LibDock
0.043345543345543344
LigandFit
0.04212454212454213
MCSS
0.002442002442002442
MODELER
0.16117216117216118
MesoDyn
0.003663003663003663
Mesocite
0.004884004884004884
Mesoscale
0.016483516483516484
Morphology
0.018925518925518924
ONETEP
0.0
Polymorph
0.006105006105006105
QMERA
0.001221001221001221
QSAR
0.002442002442002442
Quantum Mechanics
1.0
Reflex
0.13003663003663005
Reflex Plus
0.0115995115995116
Semi-empirical
0.020757020757020756
Sorption
0.04700854700854701
Synthia
0.001221001221001221
TURBOMOLE
6.105006105006105E-4
VAMP
0.01221001221001221
Visualization
0.5836385836385837
X-Cell
0.006105006105006105
ZDOCK
0.007326007326007326
Year
2003
0.0
2004
0.024115755627009645
2005
0.02572347266881029
2006
0.04983922829581994
2007
0.05627009646302251
2008
0.09485530546623794
2009
0.14790996784565916
2010
0.16559485530546625
2011
0.19292604501607716
2012
0.24437299035369775
2013
0.26688102893890675
2014
0.4405144694533762
2015
0.590032154340836
2016
0.5868167202572347
2017
0.6221864951768489
2018
0.5498392282958199
2019
0.4292604501607717
2020
0.6945337620578779
2021
0.41961414790996787
2022
1.0
2023
0.6109324758842444
2024
0.42443729903536975
2025
0.09003215434083602
2026
0.05466237942122187
Keywords
synthesized
1.0
target
0.9686087990487515
synthesis
0.28751486325802617
novel
0.20118906064209274
compound
0.13269916765755055
docking
0.12841854934601665
potential
0.10677764565992866
between
0.10059453032104637
activity
0.07300832342449465
visualization
0.07253269916765755
designed
0.06872770511296077
analysis
0.05873959571938169
experimental
0.055410225921522
design
0.04732461355529132
potent
0.02925089179548157
well
0.025208085612366232
x-ray
0.024494649227110584
energy
0.022592152199762187
chemical
0.016884661117717005
promising
0.01498216409036861
binding
0.012604042806183116
medicinal
0.009750297265160524
inhibition
0.007134363852556481
cell
0.005469678953626635
crystal
0.0
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