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Application

Discovery Studio 1.0 Materials Studio 0.3312804721580703 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.027315914489311165 Amorphous Cell 0.0997624703087886 Blends 0.0027711797307996833 CASTEP 0.15399841646872525 CDOCKER 0.17616785431512272 CHARMm 0.2735550277117973 COMPASS 0.167458432304038 COMPASS III 0.013064133016627079 COSMObase 0.0 COSMOplex 0.0 COSMOquick 0.0011876484560570072 COSMOtherm 0.023752969121140142 Catalyst 0.1916072842438638 Classical Simulations 0.5676959619952494 Conformers 0.0011876484560570072 Crystallization 0.03127474267616785 DFTB Plus 0.001583531274742676 DMol3 0.08036421219319081 DPD 0.001979414093428345 Discover 0.0027711797307996833 Forcite 0.2086302454473476 GULP 0.014251781472684086 LUDI 0.007125890736342043 LibDock 0.07086302454473475 LigandFit 0.007521773555027712 MCSS 3.95882818685669E-4 MODELER 0.07323832145684878 MesoDyn 3.95882818685669E-4 Mesocite 0.003167062549485352 Mesoscale 0.005146476642913698 Morphology 0.00791765637371338 ONETEP 7.91765637371338E-4 Polymorph 0.0 QSAR 0.0 Quantum Mechanics 0.2288202692003167 Reflex 0.022961203483768806 Reflex Plus 0.0 Semi-empirical 0.0023752969121140144 Sorption 0.01623119556611243 Synthia 0.0 VAMP 3.95882818685669E-4 Visualization 1.0 X-Cell 0.0 ZDOCK 0.030087094220110848

Year

2023 0.0

Keywords

target 1.0 visualization 0.3963963963963964 docking 0.3898044385849264 potential 0.27554383651944625 analysis 0.1863326741375522 binding 0.14062843331136013 novel 0.12239068336629312 activity 0.11272247857613711 between 0.11272247857613711 protein 0.1054713249835201 interaction 0.07514831905075807 silico 0.05998681608437706 drug 0.05625137332454406 vitro 0.05625137332454406 compound 0.05427378598110305 synthesized 0.049439683586025046 synthesis 0.04658316853438805 inhibition 0.03317952098439903 cell 0.024609975829488026 development 0.022852120413096023 treatment 0.02241265655899802 promising 0.013623379477038013 mechanism 0.011426060206548011 energy 0.008789277081960008 active 0.0
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