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Application

Discovery Studio 1.0 Materials Studio 0.41682974559686886 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04395604395604396 Amorphous Cell 0.12087912087912088 CASTEP 0.2857142857142857 CDOCKER 0.24175824175824176 CHARMm 0.4249084249084249 COMPASS 0.22344322344322345 COMPASS III 0.07326007326007326 COSMOconf 0.007326007326007326 COSMOtherm 0.04395604395604396 Catalyst 0.1282051282051282 Classical Simulations 0.8461538461538461 Crystallization 0.014652014652014652 DMol3 0.07692307692307693 Forcite 0.2857142857142857 LUDI 0.0 LibDock 0.09157509157509157 LigandFit 0.007326007326007326 MODELER 0.32967032967032966 Mesocite 0.0 Mesoscale 0.0 Morphology 0.0 Quantum Mechanics 0.3626373626373626 Reflex 0.01098901098901099 Semi-empirical 0.0 Sorption 0.02564102564102564 VAMP 0.0 Visualization 1.0 ZDOCK 0.029304029304029304

Year

2025 1.0 2026 0.0

Keywords

potential 1.0 target 0.9268680445151033 docking 0.40381558028616854 analysis 0.31001589825119236 visualization 0.21939586645468998 binding 0.1573926868044515 therapeutic 0.15421303656597773 promising 0.14308426073131955 activity 0.0985691573926868 novel 0.09538950715421304 between 0.09062003179650238 strong 0.07631160572337042 including 0.057233704292527825 vitro 0.0492845786963434 stability 0.04292527821939587 inhibition 0.04133545310015898 protein 0.04133545310015898 development 0.03815580286168521 silico 0.019077901430842606 treatment 0.012718600953895072 cell 0.00794912559618442 interaction 0.006359300476947536 synthesized 0.0047694753577106515 compound 0.001589825119236884 effective 0.0
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