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Application

Discovery Studio 1.0 Materials Studio 0.367112810707457 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06484641638225255 Amorphous Cell 0.23208191126279865 Blends 0.0 CASTEP 0.09897610921501707 CDOCKER 0.20819112627986347 CHARMm 0.46757679180887374 COMPASS 0.24573378839590443 COMPASS III 0.08532423208191127 COSMObase 0.0034129692832764505 COSMOquick 0.0 COSMOtherm 0.04778156996587031 Catalyst 0.10580204778156997 Classical Simulations 1.0 Crystallization 0.03754266211604096 DMol3 0.08532423208191127 Discover 0.0 Forcite 0.3856655290102389 GULP 0.0034129692832764505 LibDock 0.09215017064846416 LigandFit 0.0034129692832764505 MODELER 0.3720136518771331 Mesocite 0.0034129692832764505 Mesoscale 0.0034129692832764505 Morphology 0.013651877133105802 QMERA 0.0 Quantum Mechanics 0.17747440273037543 Reflex 0.020477815699658702 Semi-empirical 0.0 Sorption 0.04436860068259386 Visualization 0.8156996587030717 X-Cell 0.0 ZDOCK 0.07849829351535836

Year

2024 0.0 2025 1.0 2026 0.028169014084507043

Keywords

interaction 1.0 target 0.9056603773584906 docking 0.4229559748427673 between 0.3805031446540881 potential 0.3805031446540881 analysis 0.3128930817610063 binding 0.27358490566037735 visualization 0.1761006289308176 stability 0.09433962264150944 promising 0.0880503144654088 protein 0.08176100628930817 novel 0.0770440251572327 strong 0.0660377358490566 energy 0.06289308176100629 including 0.06132075471698113 therapeutic 0.06132075471698113 mechanism 0.04245283018867924 activity 0.03459119496855346 development 0.029874213836477988 drug 0.0220125786163522 cell 0.018867924528301886 complex 0.0047169811320754715 silico 0.0031446540880503146 compound 0.0015723270440251573 effective 0.0
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