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Application

Discovery Studio 1.0 Materials Studio 0.7026683608640406 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.08401639344262295 Amorphous Cell 0.23565573770491804 Blends 0.004098360655737705 CASTEP 0.4139344262295082 CDOCKER 0.16598360655737704 CHARMm 0.3360655737704918 COMPASS 0.32172131147540983 COMPASS III 0.07991803278688525 COSMObase 0.00819672131147541 COSMOconf 0.004098360655737705 COSMOmic 0.0 COSMOperm 0.0020491803278688526 COSMOquick 0.0 COSMOtherm 0.12704918032786885 Catalyst 0.13319672131147542 Classical Simulations 1.0 Crystallization 0.02663934426229508 DFTB Plus 0.00819672131147541 DMol3 0.14344262295081966 Discover 0.0 Forcite 0.47540983606557374 GULP 0.022540983606557378 Kinetix 0.0 LUDI 0.004098360655737705 LibDock 0.08196721311475409 LigandFit 0.0 MODELER 0.3483606557377049 MesoDyn 0.0 Mesocite 0.004098360655737705 Mesoscale 0.006147540983606557 Morphology 0.004098360655737705 ONETEP 0.0 QSAR 0.0 Quantum Mechanics 0.5471311475409836 Reflex 0.020491803278688523 Reflex Plus 0.0 Semi-empirical 0.00819672131147541 Sorption 0.036885245901639344 Visualization 0.9528688524590164 ZDOCK 0.022540983606557378

Year

2023 0.0 2024 0.4109772423025435 2025 1.0 2026 0.21151271753681392

Keywords

including 1.0 target 0.9332310053722179 potential 0.40905602455871065 docking 0.29700690713737526 analysis 0.29163468917881813 visualization 0.1849577897160399 between 0.1289332310053722 binding 0.1128165771297007 promising 0.10053722179585571 novel 0.08749040675364543 activity 0.06293169608595549 energy 0.06216423637759018 therapeutic 0.05832693783576362 stability 0.04604758250191865 interaction 0.03453568687643899 protein 0.02916346891788181 strong 0.02916346891788181 cell 0.0283960092095165 experimental 0.02762854950115119 development 0.026093630084420567 chemical 0.024558710667689946 silico 0.022256331542594012 well 0.004604758250191865 effective 7.674597083653108E-4 mechanism 0.0
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