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Application

Discovery Studio 1.0 Materials Studio 0.4539170506912442 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06888168557536467 Amorphous Cell 0.15235008103727715 Blends 0.0 CASTEP 0.3071312803889789 CDOCKER 0.18719611021069693 CHARMm 0.33225283630470015 COMPASS 0.19692058346839547 COMPASS III 0.03241491085899514 COSMObase 8.103727714748784E-4 COSMOconf 8.103727714748784E-4 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.04294975688816856 Catalyst 0.12479740680713128 Classical Simulations 0.726904376012966 Conformers 0.0 Crystallization 0.02188006482982172 DFTB Plus 0.0024311183144246355 DMol3 0.1166936790923825 DPD 8.103727714748784E-4 Discover 0.0016207455429497568 Forcite 0.26823338735818475 GULP 0.013776337115072933 LUDI 0.004862236628849271 LibDock 0.08752025931928688 LigandFit 0.0 MCSS 0.0 MODELER 0.3184764991896272 Mesocite 0.0016207455429497568 Mesoscale 0.0024311183144246355 Morphology 0.004051863857374392 Polymorph 8.103727714748784E-4 QSAR 0.0 Quantum Mechanics 0.41572123176661263 Reflex 0.013776337115072933 Semi-empirical 0.0024311183144246355 Sorption 0.02674230145867099 Visualization 1.0 X-Cell 0.0024311183144246355 ZDOCK 0.029983792544570502

Year

2023 0.2922655715263518 2024 0.6858316221765913 2025 1.0 2026 0.29637234770704995 2027 0.0

Keywords

analysis 1.0 target 0.9271095152603231 docking 0.4215439856373429 potential 0.4118491921005386 visualization 0.25385996409335726 binding 0.1518850987432675 between 0.12387791741472172 novel 0.08904847396768402 activity 0.0725314183123878 protein 0.0725314183123878 promising 0.06535008976660682 stability 0.059245960502693 interaction 0.05385996409335727 including 0.0481149012567325 therapeutic 0.03375224416517056 energy 0.03159784560143627 silico 0.027289048473967684 compound 0.019748653500897665 treatment 0.01687612208258528 strong 0.014721723518850987 drug 0.006463195691202872 mechanism 0.006463195691202872 vitro 0.0025134649910233393 cell 0.0 effective 0.0
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