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Application

Discovery Studio 1.0 Materials Studio 0.7909090909090909 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07494145199063232 Amorphous Cell 0.2529274004683841 CASTEP 0.39344262295081966 CDOCKER 0.16159250585480095 CHARMm 0.29508196721311475 COMPASS 0.32084309133489464 COMPASS III 0.08899297423887588 COSMObase 0.0 COSMOconf 0.00702576112412178 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.07259953161592506 Catalyst 0.09836065573770492 Classical Simulations 1.0 Crystallization 0.0702576112412178 DFTB Plus 0.00234192037470726 DMol3 0.14754098360655737 DPD 0.00234192037470726 Discover 0.00234192037470726 Forcite 0.4894613583138173 GULP 0.02576112412177986 LUDI 0.00234192037470726 LibDock 0.08196721311475409 LigandFit 0.0 MODELER 0.3559718969555035 Mesoscale 0.00234192037470726 Morphology 0.00702576112412178 Polymorph 0.00234192037470726 Quantum Mechanics 0.5362997658079626 Reflex 0.05620608899297424 Semi-empirical 0.00234192037470726 Sorption 0.05620608899297424 Visualization 0.8735362997658079 ZDOCK 0.03747072599531616

Year

2024 0.0 2025 1.0 2026 0.246684350132626

Keywords

well 1.0 target 0.9180633147113594 potential 0.3435754189944134 docking 0.2569832402234637 analysis 0.22811918063314712 between 0.16387337057728119 visualization 0.1564245810055866 binding 0.09590316573556797 novel 0.07169459962756052 promising 0.06797020484171322 activity 0.0670391061452514 including 0.055865921787709494 cell 0.043761638733705775 energy 0.025139664804469275 experimental 0.021415270018621976 stability 0.019553072625698324 effective 0.0111731843575419 development 0.008379888268156424 mechanism 0.008379888268156424 synthesized 0.008379888268156424 protein 0.004655493482309125 interaction 0.0037243947858473 treatment 0.0037243947858473 therapeutic 0.002793296089385475 inhibition 0.0
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