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Application

Discovery Studio 1.0 Materials Studio 0.16024340770791076 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.023086269744835967 Amorphous Cell 0.08930741190765493 Blends 0.0 CASTEP 0.07108140947752126 CDOCKER 0.2861482381530984 CHARMm 0.45625759416767925 COMPASS 0.12029161603888214 COMPASS III 0.026731470230862697 COSMObase 6.075334143377885E-4 COSMOconf 0.003037667071688943 COSMOquick 6.075334143377885E-4 COSMOtherm 0.016403402187120292 Catalyst 0.12697448359659783 Classical Simulations 0.6871202916160389 Crystallization 0.023693803159173753 DFTB Plus 0.001215066828675577 DMol3 0.03523693803159174 DPD 0.0 Discover 0.002430133657351154 Forcite 0.17375455650060753 GULP 0.002430133657351154 LUDI 0.006075334143377886 LibDock 0.1172539489671932 LigandFit 0.0054678007290400975 MODELER 0.44775212636695016 MesoDyn 0.001215066828675577 Mesoscale 0.0018226002430133657 Morphology 0.006075334143377886 QSAR 6.075334143377885E-4 Quantum Mechanics 0.10388821385176185 Reflex 0.01701093560145808 Semi-empirical 0.0018226002430133657 Sorption 0.010935601458080195 VAMP 0.0 Visualization 1.0 X-Cell 6.075334143377885E-4 ZDOCK 0.04860267314702309

Year

2025 0.0

Keywords

target 1.0 docking 0.47060653188180407 potential 0.4494556765163297 visualization 0.2920684292379471 analysis 0.2867807153965785 binding 0.19875583203732503 activity 0.13032659409020217 novel 0.12783825816485225 promising 0.1104199066874028 therapeutic 0.08895800933125972 protein 0.0818040435458787 between 0.07402799377916018 silico 0.05443234836702955 vitro 0.04447900466562986 including 0.041990668740279936 inhibition 0.038569206842923795 compound 0.024261275272161743 development 0.02021772939346812 treatment 0.016796267496111975 synthesis 0.015863141524105753 strong 0.009642301710730949 interaction 0.008087091757387248 modeler 0.004976671850699844 stability 0.004354587869362364 drug 0.0
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