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Application

Discovery Studio 1.0 Materials Studio 0.473862354268522 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05054432348367029 Amorphous Cell 0.18351477449455678 Blends 0.0 CASTEP 0.27993779160186627 CDOCKER 0.3654743390357698 CHARMm 0.45023328149300157 COMPASS 0.2869362363919129 COMPASS III 0.06687402799377916 COSMObase 0.0015552099533437014 COSMOconf 0.0 COSMOperm 0.0 COSMOquick 0.0015552099533437014 COSMOtherm 0.04121306376360809 Catalyst 0.2581648522550544 Classical Simulations 1.0 Crystallization 0.05054432348367029 DMol3 0.12597200622083982 DPD 0.0015552099533437014 Discover 7.776049766718507E-4 Forcite 0.4020217729393468 GULP 0.006998444790046656 LUDI 0.008553654743390357 LibDock 0.12986003110419908 LigandFit 0.00933125972006221 MCSS 7.776049766718507E-4 MODELER 0.3926905132192846 MesoDyn 0.0 Mesocite 0.0015552099533437014 Mesoscale 0.0038880248833592537 Morphology 0.00933125972006221 ONETEP 0.0 Polymorph 0.003110419906687403 QSAR 0.0 Quantum Mechanics 0.4004665629860031 Reflex 0.03654743390357698 Reflex Plus 7.776049766718507E-4 Sorption 0.020995334370139968 Synthia 0.0 Visualization 0.9914463452566097 X-Cell 0.0 ZDOCK 0.03576982892690513

Year

2023 0.1467018469656992 2024 0.7113456464379947 2025 1.0 2026 0.29815303430079154 2027 0.0

Keywords

novel 1.0 target 0.9449838187702265 potential 0.373050897322742 docking 0.3292144748455428 analysis 0.18240659017358046 visualization 0.17475728155339806 synthesized 0.13503971756398941 promising 0.13445130920859077 activity 0.10503089143865843 binding 0.10032362459546926 synthesis 0.0970873786407767 development 0.09032068255369226 compound 0.07208002353633422 between 0.07031479847013827 therapeutic 0.03000882612533098 vitro 0.026184171815239778 effective 0.024124742571344514 protein 0.022359517505148575 drug 0.020005884083553988 design 0.018240659017358045 stability 0.015592821418064137 inhibition 0.01147396293027361 potent 0.01059135039717564 cell 0.004707266843189173 including 0.0
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