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Application

Discovery Studio 1.0 Materials Studio 0.7537212449255751 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06437768240343347 Amorphous Cell 0.22532188841201717 CASTEP 0.40772532188841204 CDOCKER 0.17381974248927037 CHARMm 0.2907725321888412 COMPASS 0.3315450643776824 COMPASS III 0.07618025751072961 COSMObase 0.001072961373390558 COSMOconf 0.006437768240343348 COSMOperm 0.002145922746781116 COSMOquick 0.0 COSMOtherm 0.07832618025751073 Catalyst 0.12660944206008584 Classical Simulations 0.944206008583691 Crystallization 0.06759656652360516 DFTB Plus 0.004291845493562232 DMol3 0.15343347639484978 DPD 0.001072961373390558 Discover 0.003218884120171674 Forcite 0.4688841201716738 GULP 0.028969957081545063 Kinetix 0.0 LUDI 0.001072961373390558 LibDock 0.07725321888412018 LigandFit 0.006437768240343348 MODELER 0.26180257510729615 MesoDyn 0.0 Mesoscale 0.002145922746781116 Morphology 0.008583690987124463 Polymorph 0.001072961373390558 QSAR 0.0 Quantum Mechanics 0.5547210300429185 Reflex 0.05686695278969957 Semi-empirical 0.006437768240343348 Sorption 0.046137339055793994 Synthia 0.001072961373390558 VAMP 0.001072961373390558 Visualization 1.0 X-Cell 0.0 ZDOCK 0.033261802575107295

Year

2022 0.0 2023 0.33197721724979656 2024 0.645240032546786 2025 1.0 2026 0.305939788445891

Keywords

well 1.0 target 0.9406815313420278 potential 0.31131678586453515 docking 0.27513672696676483 visualization 0.21076987799747582 analysis 0.19941102229701305 between 0.15692048801009675 binding 0.09465713083718974 novel 0.08624316365166176 activity 0.0740429112326462 energy 0.04080774084981069 promising 0.03996634413125789 cell 0.037442153975599496 including 0.03323517038283551 experimental 0.032393773664282706 protein 0.02524190155658393 interaction 0.02440050483803113 stability 0.023138409760201935 synthesized 0.022297013041649136 mechanism 0.01430374421539756 development 0.008834665544804375 vitro 0.005889777029869584 effective 0.005469078670593185 silico 0.0037862852334875894 drug 0.0
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