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Application

Discovery Studio 1.0 Materials Studio 0.16216216216216217 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.014852985753258564 Amorphous Cell 0.026371627765989693 Antibody 3.031221582297666E-4 Blends 0.0 CASTEP 0.08911791451955138 CDOCKER 0.2685662321915732 CHARMm 0.3249469536223098 COMPASS 0.04759017884207335 COMPASS III 0.010912397696271597 COSMObase 9.093664746892998E-4 COSMOconf 0.0012124886329190664 COSMOperm 0.0 COSMOtherm 0.019702940284934828 Catalyst 0.18035768414671113 Classical Simulations 0.4295240982115793 Conformers 3.031221582297666E-4 Crystallization 0.018490451652015762 DFTB Plus 3.031221582297666E-4 DMol3 0.10427402243103971 DPD 3.031221582297666E-4 Discover 6.062443164595332E-4 Forcite 0.07153682934222491 GULP 0.003031221582297666 LUDI 0.003637465898757199 LibDock 0.10154592300697181 LigandFit 0.013034252803879964 MCSS 0.0018187329493785996 MODELER 0.25492573507123373 MesoDyn 3.031221582297666E-4 Mesocite 9.093664746892998E-4 Mesoscale 0.001515610791148833 Morphology 0.0018187329493785996 ONETEP 0.0 Polymorph 0.0 QMERA 3.031221582297666E-4 QSAR 9.093664746892998E-4 Quantum Mechanics 0.18975447105183388 Reflex 0.016368596544407397 Semi-empirical 0.001515610791148833 Sorption 0.005153076689906032 VAMP 3.031221582297666E-4 Visualization 1.0 X-Cell 0.0 ZDOCK 0.032737193088814794

Year

2019 0.03152885187388459 2020 0.10945865556216537 2021 0.1338488994646044 2022 0.44735276621058895 2023 0.7239738251041047 2024 1.0 2025 0.7757287328970851 2026 0.0

Keywords

activity 1.0 target 0.967920725562647 docking 0.4576755122606651 visualization 0.35203224722875376 potential 0.3503527040644945 analysis 0.20154517971111857 novel 0.16409136714813571 binding 0.14863957003694994 vitro 0.12059119919381928 compound 0.09573396036278133 inhibition 0.09119919381928115 synthesis 0.08901578770574403 synthesized 0.08750419885791065 protein 0.08532079274437353 silico 0.07037285858246557 promising 0.0658380920389654 between 0.05727242190124286 potent 0.037621766879408804 active 0.034934497816593885 treatment 0.03123950285522338 drug 0.02888814242526033 development 0.020658380920389654 interaction 0.013772253946926436 enzyme 0.0023513604299630502 effective 0.0
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