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Application

Discovery Studio 1.0 Materials Studio 0.6089918256130791 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06553398058252427 Amorphous Cell 0.21844660194174756 Blends 0.0 CASTEP 0.3592233009708738 CDOCKER 0.1820388349514563 CHARMm 0.3616504854368932 COMPASS 0.2936893203883495 COMPASS III 0.09951456310679611 COSMObase 0.0048543689320388345 COSMOconf 0.0024271844660194173 COSMOquick 0.0 COSMOtherm 0.07281553398058252 Catalyst 0.10194174757281553 Classical Simulations 0.9854368932038835 Crystallization 0.055825242718446605 DFTB Plus 0.0048543689320388345 DMol3 0.11893203883495146 DPD 0.0 Forcite 0.4393203883495146 GULP 0.02669902912621359 LUDI 0.0 LibDock 0.08980582524271845 LigandFit 0.0 MCSS 0.0 MODELER 0.3762135922330097 Mesocite 0.007281553398058253 Mesoscale 0.007281553398058253 Morphology 0.009708737864077669 ONETEP 0.0 Polymorph 0.0 QSAR 0.0 Quantum Mechanics 0.470873786407767 Reflex 0.0412621359223301 Semi-empirical 0.0048543689320388345 Sorption 0.03155339805825243 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03155339805825243

Year

2023 0.014150943396226415 2024 0.5959119496855346 2025 1.0 2026 0.3946540880503145 2027 0.0

Keywords

including 1.0 target 0.9285051067780873 potential 0.4428969359331476 docking 0.32404828226555243 analysis 0.29619312906220985 visualization 0.20148560817084493 binding 0.1327762302692665 promising 0.12720519962859797 between 0.1095636025998143 novel 0.10027855153203342 therapeutic 0.0807799442896936 activity 0.07706592386258125 energy 0.04735376044568245 interaction 0.0436397400185701 protein 0.04085422469823584 stability 0.033426183844011144 strong 0.031569173630454965 development 0.03064066852367688 effective 0.02042711234911792 silico 0.02042711234911792 experimental 0.018570102135561744 treatment 0.012999071494893221 cell 0.011142061281337047 chemical 0.0 inhibition 0.0
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