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Application

Discovery Studio 1.0 Materials Studio 0.5569948186528497 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0447427293064877 Amorphous Cell 0.2550335570469799 Blends 0.0 CASTEP 0.19015659955257272 CDOCKER 0.22818791946308725 CHARMm 0.348993288590604 COMPASS 0.29977628635346754 COMPASS III 0.11185682326621924 COSMObase 0.0 COSMOconf 0.006711409395973154 COSMOperm 0.0 COSMOplex 0.0 COSMOtherm 0.05145413870246085 Catalyst 0.12304250559284116 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.08277404921700224 DFTB Plus 0.0022371364653243847 DMol3 0.0894854586129754 Discover 0.0022371364653243847 Forcite 0.49440715883668906 GULP 0.006711409395973154 LUDI 0.0022371364653243847 LibDock 0.116331096196868 LigandFit 0.0022371364653243847 MODELER 0.31767337807606266 Mesocite 0.0044742729306487695 Mesoscale 0.0044742729306487695 Morphology 0.020134228187919462 Polymorph 0.0 Quantum Mechanics 0.27740492170022374 Reflex 0.058165548098434 Reflex Plus 0.0 Semi-empirical 0.0022371364653243847 Sorption 0.058165548098434 Synthia 0.0022371364653243847 Visualization 0.930648769574944 X-Cell 0.0 ZDOCK 0.040268456375838924

Year

2025 1.0 2026 0.0

Keywords

target 1.0 potential 0.3719262295081967 docking 0.33401639344262296 analysis 0.23668032786885246 visualization 0.22540983606557377 promising 0.12192622950819672 binding 0.11577868852459017 novel 0.09631147540983606 between 0.0942622950819672 activity 0.08709016393442623 therapeutic 0.06352459016393443 including 0.0584016393442623 cell 0.0471311475409836 strong 0.0430327868852459 stability 0.02459016393442623 effective 0.00819672131147541 energy 0.00819672131147541 compound 0.007172131147540984 protein 0.007172131147540984 vitro 0.007172131147540984 interaction 0.006147540983606557 development 0.005122950819672131 synthesis 0.005122950819672131 mechanism 0.0 synthesized 0.0
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