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Application

Discovery Studio 1.0 Materials Studio 0.902676399026764 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07581227436823104 Amorphous Cell 0.25511432009626955 CASTEP 0.4584837545126354 CDOCKER 0.16365824308062576 CHARMm 0.27557160048134777 COMPASS 0.37063778580024065 COMPASS III 0.08784596871239471 COSMObase 0.0012033694344163659 COSMOconf 0.006016847172081829 COSMOperm 0.0024067388688327317 COSMOquick 0.0 COSMOtherm 0.0842358604091456 Catalyst 0.1095066185318893 Classical Simulations 1.0 Crystallization 0.07220216606498195 DFTB Plus 0.0048134777376654635 DMol3 0.17328519855595667 DPD 0.0024067388688327317 Discover 0.0036101083032490976 Forcite 0.51985559566787 GULP 0.027677496991576414 Kinetix 0.0 LUDI 0.0012033694344163659 LibDock 0.07340553549939831 LigandFit 0.0036101083032490976 MODELER 0.2779783393501805 MesoDyn 0.0 Mesocite 0.0 Mesoscale 0.0036101083032490976 Morphology 0.007220216606498195 Polymorph 0.0012033694344163659 QSAR 0.0 Quantum Mechanics 0.6245487364620939 Reflex 0.06257521058965103 Semi-empirical 0.007220216606498195 Sorption 0.05415162454873646 Synthia 0.0012033694344163659 TURBOMOLE 0.0 VAMP 0.0012033694344163659 Visualization 0.9229843561973526 X-Cell 0.0 ZDOCK 0.02888086642599278

Year

2023 0.0 2024 0.5240847784200385 2025 1.0 2026 0.17148362235067438

Keywords

well 1.0 target 0.9371847776249427 potential 0.3218707015130674 docking 0.25034387895460797 analysis 0.19669876203576342 visualization 0.18110958276020175 between 0.17744154057771663 novel 0.09032553874369555 binding 0.08986703347088491 activity 0.07427785419532325 energy 0.06419073819348922 promising 0.04951856946354883 cell 0.048143053645116916 experimental 0.0453920220082531 including 0.04126547455295736 stability 0.0307198532783127 mechanism 0.026134800550206328 interaction 0.02567629527739569 synthesized 0.024300779458963778 protein 0.016047684548372305 development 0.015130674002751032 effective 0.014672168729940394 vitro 0.009170105456212746 silico 0.001375515818431912 chemical 0.0
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