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Application

Discovery Studio 1.0 Materials Studio 0.5287656903765691 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07242339832869081 Amorphous Cell 0.17363045496750232 CASTEP 0.3491179201485608 CDOCKER 0.1977715877437326 CHARMm 0.3491179201485608 COMPASS 0.22376973073351902 COMPASS III 0.04271123491179202 COSMObase 0.0018570102135561746 COSMOconf 0.0018570102135561746 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.0436397400185701 Catalyst 0.10120705663881151 Classical Simulations 0.8133704735376045 Conformers 0.0 Crystallization 0.035283194057567316 DFTB Plus 9.285051067780873E-4 DMol3 0.13370473537604458 DPD 0.0 Discover 9.285051067780873E-4 Forcite 0.31940575673166205 GULP 0.016713091922005572 LUDI 0.002785515320334262 LibDock 0.1021355617455896 LigandFit 9.285051067780873E-4 MODELER 0.3565459610027855 Mesocite 9.285051067780873E-4 Mesoscale 9.285051067780873E-4 Modules 0.0 Morphology 0.012070566388115135 Polymorph 0.0018570102135561746 QSAR 0.0018570102135561746 Quantum Mechanics 0.47075208913649025 Reflex 0.018570102135561744 Reflex Plus 0.0 Semi-empirical 9.285051067780873E-4 Sorption 0.03064066852367688 Visualization 1.0 X-Cell 9.285051067780873E-4 ZDOCK 0.02692664809656453

Year

2023 0.0 2024 0.6095890410958904 2025 1.0 2026 0.21689497716894976

Keywords

analysis 1.0 target 0.9200156067108857 potential 0.4147483417869684 docking 0.3909481076863051 visualization 0.22707764338665626 binding 0.1533359344518143 between 0.1408505657432696 novel 0.07725321888412018 promising 0.07257120561841592 stability 0.0593055013655872 protein 0.05852516582130316 including 0.05111197815060476 interaction 0.05072181037846274 activity 0.047990635973468594 energy 0.04291845493562232 therapeutic 0.034334763948497854 silico 0.02809207959422552 strong 0.01443620756925478 mechanism 0.009754194303550527 vitro 0.006632852126414358 drug 0.0039016777214202106 development 0.0023410066328521262 experimental 0.0019508388607101053 treatment 0.0015606710885680843 effective 0.0
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