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Application

Discovery Studio 1.0 Materials Studio 0.4674724493423391 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06264775413711583 Amorphous Cell 0.14479905437352245 Blends 8.865248226950354E-4 CASTEP 0.29994089834515364 CDOCKER 0.1705082742316785 CHARMm 0.30969267139479906 COMPASS 0.19680851063829788 COMPASS III 0.03664302600472813 COSMObase 0.0017730496453900709 COSMOconf 0.0020685579196217494 COSMOmic 0.0 COSMOperm 5.91016548463357E-4 COSMOplex 0.0 COSMOquick 2.955082742316785E-4 COSMOtherm 0.04225768321513002 Catalyst 0.12559101654846336 Classical Simulations 0.7006501182033097 Conformers 5.91016548463357E-4 Crystallization 0.026004728132387706 DFTB Plus 0.004432624113475178 DMol3 0.10904255319148937 DPD 8.865248226950354E-4 Discover 0.001182033096926714 Forcite 0.2700945626477541 GULP 0.015366430260047281 Kinetix 0.0 LUDI 0.004728132387706856 LibDock 0.08392434988179669 LigandFit 0.0026595744680851063 MCSS 0.0 MODELER 0.24793144208037826 MesoDyn 0.0 Mesocite 0.0014775413711583924 Mesoscale 0.002364066193853428 Modules 0.0 Morphology 0.0067966903073286055 Polymorph 5.91016548463357E-4 QMERA 2.955082742316785E-4 QSAR 0.0014775413711583924 Quantum Mechanics 0.39952718676122934 Reflex 0.016843971631205674 Reflex Plus 2.955082742316785E-4 Semi-empirical 0.0062056737588652485 Sorption 0.024231678486997636 Synthia 2.955082742316785E-4 VAMP 8.865248226950354E-4 Visualization 1.0 X-Cell 0.001182033096926714 ZDOCK 0.02925531914893617

Year

2021 0.0035830618892508143 2022 0.20977198697068403 2023 0.48697068403908794 2024 0.8449511400651466 2025 1.0 2026 0.2876221498371335 2027 0.0

Keywords

analysis 1.0 target 0.9383429672447013 docking 0.4046242774566474 potential 0.39154968345719793 visualization 0.27208918249380676 binding 0.14505917974126067 between 0.13804018717313515 novel 0.08161299201761629 protein 0.07665840902835122 activity 0.0685383980181668 interaction 0.06633636113404899 promising 0.04720616570327553 including 0.04252683732452518 stability 0.041563446187723646 silico 0.03770988164051748 energy 0.030002752546105148 drug 0.012661712083677402 compound 0.011010184420589045 mechanism 0.009083402146985962 therapeutic 0.008395265620699147 vitro 0.007431874483897605 experimental 0.003991191852463528 treatment 0.002064409578860446 cell 2.752546105147261E-4 effective 0.0
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