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Application

Discovery Studio 0.9435419440745673 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059202059202059204 Amorphous Cell 0.2812097812097812 Blends 0.0019305019305019305 CASTEP 0.3124195624195624 CDOCKER 0.16216216216216217 CHARMm 0.25933075933075933 COMPASS 0.3465250965250965 COMPASS III 0.10842985842985843 COSMObase 0.005148005148005148 COSMOconf 0.005791505791505791 COSMOmic 0.0 COSMOperm 6.435006435006435E-4 COSMOplex 3.2175032175032174E-4 COSMOquick 6.435006435006435E-4 COSMOtherm 0.0637065637065637 Catalyst 0.06917631917631918 Classical Simulations 1.0 Conformers 3.2175032175032174E-4 Crystallization 0.07368082368082368 DFTB Plus 0.0028957528957528956 DMol3 0.14864864864864866 DPD 0.0022522522522522522 Discover 0.0054697554697554695 Forcite 0.5315315315315315 GULP 0.015765765765765764 Kinetix 0.0 LUDI 0.003861003861003861 LibDock 0.06724581724581724 LigandFit 0.0032175032175032173 MODELER 0.24806949806949807 MesoDyn 6.435006435006435E-4 Mesocite 0.0035392535392535394 Mesoscale 0.006113256113256113 Morphology 0.01705276705276705 ONETEP 6.435006435006435E-4 Polymorph 0.002574002574002574 QMERA 3.2175032175032174E-4 QSAR 3.2175032175032174E-4 Quantum Mechanics 0.4523809523809524 Reflex 0.05276705276705277 Reflex Plus 6.435006435006435E-4 Semi-empirical 0.004182754182754183 Sorption 0.05855855855855856 Synthia 6.435006435006435E-4 TURBOMOLE 0.0 VAMP 3.2175032175032174E-4 Visualization 0.6550836550836551 X-Cell 0.0016087516087516086 ZDOCK 0.02734877734877735

Year

2024 0.09527559055118111 2025 1.0 2026 0.9761154855643045 2027 0.0

Keywords

target 1.0 potential 0.32045609257998636 analysis 0.2283866575901974 docking 0.21902654867256638 visualization 0.1570796460176991 between 0.13835942818243704 promising 0.09581347855684139 novel 0.08900612661674609 energy 0.07845473110959837 binding 0.07573179033356024 cell 0.06569094622191968 stability 0.046460176991150445 activity 0.0439074200136147 performance 0.043396868618107556 strong 0.029271613342409804 including 0.02773995915588836 enhanced 0.018720217835262083 effective 0.01735874744724302 mechanism 0.011402314499659632 development 0.01123213070115725 strategy 0.011061946902654867 synthesized 0.010211027910142955 experimental 0.0051055139550714775 design 8.509189925119128E-4 interaction 0.0
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