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Application

Discovery Studio 1.0 Materials Studio 0.13691026827012026 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.012121212121212121 Amorphous Cell 0.04040404040404041 CASTEP 0.09898989898989899 CDOCKER 0.3434343434343434 CHARMm 0.42424242424242425 COMPASS 0.050505050505050504 COMPASS III 0.024242424242424242 COSMObase 0.0 COSMOconf 0.0 COSMOtherm 0.03232323232323232 Catalyst 0.18181818181818182 Classical Simulations 0.5494949494949495 Crystallization 0.012121212121212121 DMol3 0.09494949494949495 Discover 0.0 Forcite 0.07474747474747474 GULP 0.00404040404040404 LUDI 0.0 LibDock 0.12121212121212122 LigandFit 0.00808080808080808 MODELER 0.4686868686868687 Morphology 0.0 QMERA 0.0 Quantum Mechanics 0.1919191919191919 Reflex 0.012121212121212121 Semi-empirical 0.0 Sorption 0.0 Visualization 1.0 ZDOCK 0.03838383838383838

Year

2023 0.0 2024 0.838351822503962 2025 1.0 2026 0.15213946117274169

Keywords

activity 1.0 target 0.9675572519083969 docking 0.4780534351145038 potential 0.44561068702290074 visualization 0.25572519083969464 analysis 0.25286259541984735 binding 0.15553435114503816 novel 0.15267175572519084 vitro 0.13454198473282442 promising 0.11164122137404581 inhibition 0.09255725190839695 silico 0.08492366412213741 protein 0.07442748091603053 compound 0.06679389312977099 synthesis 0.06583969465648855 between 0.0648854961832061 synthesized 0.0648854961832061 therapeutic 0.03148854961832061 potent 0.02862595419847328 development 0.019083969465648856 treatment 0.01431297709923664 including 0.0028625954198473282 modeler 9.541984732824427E-4 drug 0.0 effective 0.0
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