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Application

Discovery Studio 1.0 Materials Studio 0.17819905213270143 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.014938488576449912 Amorphous Cell 0.028119507908611598 CASTEP 0.09578207381370826 CDOCKER 0.2680140597539543 CHARMm 0.3471001757469244 COMPASS 0.05184534270650264 COMPASS III 0.01845342706502636 COSMObase 0.0 COSMOconf 8.787346221441124E-4 COSMOtherm 0.020210896309314587 Catalyst 0.17486818980667837 Classical Simulations 0.46924428822495606 Conformers 0.0 Crystallization 0.023725834797891036 DMol3 0.10896309314586995 DPD 0.0 Discover 8.787346221441124E-4 Forcite 0.08347978910369068 GULP 0.004393673110720563 LUDI 0.0017574692442882249 LibDock 0.11687170474516696 LigandFit 0.005272407732864675 MODELER 0.2565905096660808 MesoDyn 0.0 Mesocite 0.0 Mesoscale 8.787346221441124E-4 Morphology 0.0017574692442882249 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.20123022847100175 Reflex 0.021968365553602813 Semi-empirical 0.0 Sorption 0.007029876977152899 Visualization 1.0 ZDOCK 0.028119507908611598

Year

2022 0.12466124661246612 2023 0.6693766937669376 2024 1.0 2025 0.8685636856368564 2026 0.0

Keywords

activity 1.0 target 0.9611374407582939 docking 0.45829383886255926 potential 0.37772511848341234 visualization 0.3293838862559242 analysis 0.21753554502369668 novel 0.16161137440758294 binding 0.15497630331753554 vitro 0.11611374407582939 compound 0.09336492890995261 protein 0.0909952606635071 inhibition 0.08483412322274882 silico 0.08199052132701422 synthesized 0.08104265402843602 promising 0.07819905213270142 synthesis 0.07772511848341232 between 0.06018957345971564 potent 0.024644549763033177 active 0.023696682464454975 development 0.022748815165876776 drug 0.01990521327014218 treatment 0.016113744075829384 interaction 0.012796208530805687 effective 0.0042654028436018955 therapeutic 0.0
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