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Application

Discovery Studio 1.0 Materials Studio 0.9798769103104903 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06725335803612784 Amorphous Cell 0.2754979157017138 Blends 0.002686428902269569 CASTEP 0.3933302454840204 CDOCKER 0.17628531727651692 CHARMm 0.2623436776285317 COMPASS 0.3683186660490968 COMPASS III 0.0778138026864289 COSMObase 0.0029643353404353867 COSMOconf 0.0037054191755442334 COSMOmic 2.779064381658175E-4 COSMOperm 0.0012042612320518759 COSMOplex 2.779064381658175E-4 COSMOquick 0.001667438628994905 COSMOtherm 0.062158406669754515 Cantera 0.0 Catalyst 0.11097730430754979 Classical Simulations 1.0 Conformers 0.0010189902732746642 Crystallization 0.07549791570171376 DFTB Plus 0.005002315886984715 DMol3 0.18045391384900417 DPD 0.002871699861046781 Discover 0.004631773969430292 Forcite 0.5333950903195924 GULP 0.024177860120426123 Kinetix 1.8527095877721167E-4 LUDI 0.00555812876331635 LibDock 0.07086614173228346 LigandFit 0.007688744789254284 MCSS 0.0012042612320518759 MODELER 0.2094488188976378 MesoDyn 0.0012042612320518759 Mesocite 0.0036127836961556276 Mesoscale 0.006855025474756832 Modules 0.0 Morphology 0.017508105604446503 ONETEP 0.0014821676702176934 Polymorph 0.001667438628994905 QMERA 1.8527095877721167E-4 QSAR 0.0012042612320518759 Quantum Mechanics 0.5621120889300603 Reflex 0.05585919407132932 Reflex Plus 8.337193144974525E-4 Semi-empirical 0.006855025474756832 Sorption 0.05567392311255211 Synthia 0.00111162575266327 TURBOMOLE 4.631773969430292E-4 VAMP 0.0014821676702176934 Visualization 0.8477999073645206 X-Cell 0.0012968967114404817 ZDOCK 0.03001389532190829

Year

2020 0.0630843327981868 2021 0.1434507507791104 2022 0.16347152705637927 2023 0.3432807630560015 2024 0.7780715837189537 2025 1.0 2026 0.40145433940882047 2027 0.0

Keywords

target 1.0 potential 0.2656945327399873 docking 0.21471710108073744 visualization 0.20494278448823902 analysis 0.18336776859504134 between 0.15321042593769865 novel 0.10084233947870312 energy 0.08264462809917356 binding 0.07116179275270185 cell 0.059758423394787034 activity 0.0539574062301335 promising 0.051056897647806736 interaction 0.03691195168467896 stability 0.029283216783216784 synthesized 0.026541640178003815 experimental 0.02602511125238398 mechanism 0.019747298156389065 effective 0.018833439287984744 performance 0.018833439287984744 protein 0.01823744437380801 development 0.016171328671328672 synthesis 0.011085505403687222 including 0.010370311506675143 design 0.0015098537825810553 chemical 0.0
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