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Application

Discovery Studio 1.0 Materials Studio 0.3476686283386148 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.051226551226551224 Amorphous Cell 0.049783549783549784 Blends 0.0 CASTEP 0.1608946608946609 CDOCKER 0.18831168831168832 CHARMm 0.24242424242424243 COMPASS 0.12481962481962482 COMPASS III 0.027417027417027416 COSMObase 0.0 COSMOperm 7.215007215007215E-4 COSMOquick 7.215007215007215E-4 COSMOtherm 0.020923520923520924 Catalyst 0.21861471861471862 Classical Simulations 0.5173160173160173 Conformers 7.215007215007215E-4 Crystallization 0.05194805194805195 DFTB Plus 0.001443001443001443 DMol3 0.09379509379509379 DPD 0.0 Discover 0.0021645021645021645 Forcite 0.17893217893217894 GULP 0.005772005772005772 Kinetix 0.0 LUDI 0.005772005772005772 LibDock 0.06421356421356421 LigandFit 0.007215007215007215 MCSS 0.002886002886002886 MODELER 0.1305916305916306 MesoDyn 0.0 Mesocite 0.0 Mesoscale 7.215007215007215E-4 Morphology 0.006493506493506494 QSAR 0.0 Quantum Mechanics 0.2510822510822511 Reflex 0.046176046176046176 Semi-empirical 0.001443001443001443 Sorption 0.018037518037518036 Visualization 1.0 ZDOCK 0.007215007215007215

Year

2019 0.0 2020 0.26354679802955666 2021 0.39532019704433496 2022 0.45197044334975367 2023 0.6748768472906403 2024 1.0 2025 0.8226600985221675 2026 0.16502463054187191

Keywords

synthesis 1.0 target 0.9732824427480916 docking 0.4450381679389313 synthesized 0.4183206106870229 visualization 0.3568702290076336 novel 0.27633587786259545 potential 0.27633587786259545 compound 0.20610687022900764 activity 0.18358778625954197 design 0.15916030534351144 analysis 0.14198473282442747 binding 0.09923664122137404 promising 0.09389312977099237 vitro 0.09083969465648854 inhibition 0.08969465648854962 potent 0.0881679389312977 between 0.059923664122137406 active 0.04389312977099236 silico 0.034732824427480914 designed 0.02633587786259542 drug 0.019465648854961833 effective 0.010305343511450382 protein 0.009923664122137405 evaluation 0.007633587786259542 enzyme 0.0
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