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Application

Discovery Studio 1.0 Materials Studio 0.6211393273850377 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07881002087682672 Amorphous Cell 0.10855949895615867 Blends 5.219206680584551E-4 CASTEP 0.26461377870563674 CDOCKER 0.18789144050104384 CHARMm 0.24634655532359082 COMPASS 0.21920668058455114 COMPASS III 0.03966597077244259 COSMObase 0.0 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 5.219206680584551E-4 COSMOquick 5.219206680584551E-4 COSMOtherm 0.02139874739039666 Catalyst 0.22755741127348644 Classical Simulations 0.7192066805845512 Conformers 0.0 Crystallization 0.09446764091858037 DFTB Plus 0.003131524008350731 DMol3 0.11116910229645094 DPD 0.0 Discover 0.0 Forcite 0.32828810020876825 GULP 0.009916492693110648 LUDI 0.004697286012526096 LibDock 0.059498956158663886 LigandFit 0.0041753653444676405 MCSS 0.0015657620041753654 MODELER 0.10542797494780794 MesoDyn 0.0 Mesocite 0.0010438413361169101 Mesoscale 0.0020876826722338203 Morphology 0.013048016701461378 QSAR 5.219206680584551E-4 Quantum Mechanics 0.3731732776617954 Reflex 0.08037578288100208 Reflex Plus 0.0010438413361169101 Semi-empirical 0.0036534446764091857 Sorption 0.03496868475991649 Synthia 0.0010438413361169101 TURBOMOLE 0.0 VAMP 0.0 Visualization 1.0 X-Cell 0.0026096033402922755 ZDOCK 0.0036534446764091857

Year

2020 0.08028720626631854 2021 0.18733681462140991 2022 0.22193211488250653 2023 0.45430809399477806 2024 0.8740208877284595 2025 1.0 2026 0.34660574412532635 2027 0.0

Keywords

synthesized 1.0 target 0.959600876125578 docking 0.3718666342175712 synthesis 0.3645655877342419 visualization 0.28425407641761985 potential 0.2801168167437333 novel 0.2672183012898515 compound 0.18715015818934047 analysis 0.1567291311754685 activity 0.14358724750547577 binding 0.10635191044049647 promising 0.09247992212217085 design 0.07495741056218058 between 0.06692625943051837 vitro 0.0666828912144074 designed 0.06546605013385252 potent 0.06497931370163057 inhibition 0.06351910440496471 experimental 0.01825261620832319 silico 0.017522511559990267 cell 0.015818934047213434 active 0.015575565831102457 effective 0.012655147237770748 drug 0.011194937941104892 development 0.0
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