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Application

Discovery Studio 1.0 Materials Studio 0.29713292788879236 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05245901639344262 Amorphous Cell 0.06557377049180328 Blends 0.0 CASTEP 0.14754098360655737 CDOCKER 0.20655737704918034 CHARMm 0.3262295081967213 COMPASS 0.11311475409836065 COMPASS III 0.05081967213114754 COSMObase 0.0 COSMOperm 0.0 COSMOtherm 0.019672131147540985 Catalyst 0.3 Classical Simulations 0.6360655737704918 Crystallization 0.06229508196721312 DFTB Plus 0.0 DMol3 0.08688524590163935 Discover 0.001639344262295082 Forcite 0.21147540983606558 GULP 0.004918032786885246 LUDI 0.004918032786885246 LibDock 0.08688524590163935 MCSS 0.0 MODELER 0.25245901639344265 Mesocite 0.0 Mesoscale 0.0 Morphology 0.011475409836065573 Quantum Mechanics 0.23114754098360657 Reflex 0.05081967213114754 Semi-empirical 0.0 Sorption 0.021311475409836064 Visualization 1.0 ZDOCK 0.009836065573770493

Year

2024 0.490521327014218 2025 1.0 2026 0.3246445497630332 2027 0.0

Keywords

synthesis 1.0 target 0.95625 docking 0.45625 synthesized 0.39453125 potential 0.35234375 visualization 0.278125 novel 0.26484375 compound 0.1859375 analysis 0.1734375 activity 0.16640625 promising 0.16640625 design 0.1515625 binding 0.13046875 vitro 0.09375 inhibition 0.08671875 potent 0.08046875 silico 0.05546875 between 0.053125 strong 0.0234375 development 0.0171875 including 0.01015625 drug 0.00859375 effective 7.8125E-4 protein 7.8125E-4 evaluation 0.0
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