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Application
Discovery Studio
1.0
Materials Studio
0.5497752087347463
Solvation Chemistry
0.0
Modules
Adsorption Locator
0.04783258594917788
Amorphous Cell
0.07324364723467862
Blends
0.0029895366218236174
CASTEP
0.7608370702541106
CDOCKER
0.5321375186846039
CHARMm
0.6337817638266069
COMPASS
0.17638266068759342
COMPASS III
0.007473841554559043
COSMObase
0.0
COSMOconf
0.0
COSMOperm
0.0
COSMOquick
0.0
COSMOtherm
0.07174887892376682
Catalyst
0.7563527653213752
Classical Simulations
1.0
Crystallization
0.09865470852017937
DFTB Plus
0.0
DMol3
0.20926756352765322
DPD
0.0029895366218236174
Discover
0.029895366218236172
Forcite
0.15844544095665172
GULP
0.053811659192825115
LUDI
0.04932735426008968
LibDock
0.12257100149476831
LigandFit
0.11958146487294469
MCSS
0.005979073243647235
MODELER
0.3781763826606876
Mesocite
0.0014947683109118087
Mesoscale
0.004484304932735426
Morphology
0.01195814648729447
ONETEP
0.0
Polymorph
0.02092675635276532
QSAR
0.0029895366218236174
Quantum Mechanics
0.9566517189835575
Reflex
0.052316890881913304
Reflex Plus
0.007473841554559043
Reflex QPA
0.0
Semi-empirical
0.01046337817638266
Sorption
0.014947683109118086
TURBOMOLE
0.0
VAMP
0.008968609865470852
Visualization
0.8430493273542601
X-Cell
0.016442451420029897
ZDOCK
0.0029895366218236174
Year
2003
0.0
2004
0.04721030042918455
2005
0.04721030042918455
2006
0.12446351931330472
2007
0.11587982832618025
2008
0.12875536480686695
2009
0.20600858369098712
2010
0.26180257510729615
2011
0.23605150214592274
2012
0.27467811158798283
2013
0.6781115879828327
2014
1.0
2015
0.8969957081545065
2016
0.6909871244635193
2017
0.8755364806866953
2018
0.8412017167381974
2019
0.927038626609442
2020
0.47639484978540775
2021
0.6523605150214592
2022
0.7510729613733905
2023
0.7553648068669528
2024
0.23605150214592274
2025
0.3261802575107296
2026
0.02575107296137339
Keywords
compound
1.0
target
0.9528432732316228
docking
0.2436430883032825
novel
0.22422561257512713
synthesized
0.20943134535367544
potential
0.1900138696255201
synthesis
0.15996301433194637
activity
0.13592233009708737
potent
0.11326860841423948
analysis
0.08321775312066575
visualization
0.08044382801664356
medicinal
0.07258437355524734
inhibition
0.07212205270457697
catalyst
0.06102635228848821
binding
0.04854368932038835
vitro
0.03975959315765141
between
0.038834951456310676
design
0.030975496994914472
well
0.016643550624133148
experimental
0.01155802126675913
designed
0.011095700416088766
cell
0.00878409616273694
promising
0.008321775312066574
drug
0.005547850208044383
chemical
0.0
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