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Application

Discovery Studio 1.0 Materials Studio 0.37485714285714283 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04706734250543085 Amorphous Cell 0.11947863866763216 Blends 7.24112961622013E-4 CASTEP 0.25633598841419264 CDOCKER 0.2433019551049964 CHARMm 0.41346850108616945 COMPASS 0.17451122375090514 COMPASS III 0.05358435916002897 COSMObase 0.002172338884866039 COSMOconf 0.004344677769732078 COSMOquick 0.0 COSMOtherm 0.05213613323678494 Catalyst 0.11368573497465605 Classical Simulations 0.7871107892831282 Crystallization 0.03186097031136857 DFTB Plus 0.0 DMol3 0.10789283128167994 DPD 7.24112961622013E-4 Discover 0.003620564808110065 Forcite 0.24764663287472846 GULP 0.012309920347574221 Kinetix 0.0 LUDI 0.0065170166545981175 LibDock 0.10716871832005793 LigandFit 0.004344677769732078 MODELER 0.36567704561911657 Mesocite 7.24112961622013E-4 Mesoscale 0.002172338884866039 Morphology 0.0065170166545981175 Polymorph 0.001448225923244026 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.3577118030412744 Reflex 0.023171614771904415 Semi-empirical 0.001448225923244026 Sorption 0.023171614771904415 VAMP 0.0 Visualization 1.0 X-Cell 0.002172338884866039 ZDOCK 0.03403330919623461

Year

2024 0.2503103020273066 2025 1.0 2026 0.3351261894911047 2027 0.0

Keywords

potential 1.0 target 0.9272211720226843 docking 0.4127284183994959 analysis 0.31568998109640833 visualization 0.22967863894139887 binding 0.16855702583490864 promising 0.16099558916194076 novel 0.12255828607435412 therapeutic 0.12003780718336483 between 0.09010712035286704 activity 0.08727158160050409 including 0.06080655324511657 strong 0.05860113421550094 protein 0.0573408947700063 silico 0.046313799621928164 stability 0.046313799621928164 vitro 0.04190296156269691 development 0.031190926275992438 inhibition 0.02835538752362949 treatment 0.027725267800882167 compound 0.020478890989287964 effective 0.017958412098298678 drug 0.013862633900441084 interaction 0.007561436672967864 synthesized 0.0
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