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Application

Discovery Studio 1.0 Materials Studio 0.32789115646258504 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.043278688524590166 Amorphous Cell 0.09836065573770492 Blends 0.0 CASTEP 0.22819672131147542 CDOCKER 0.23868852459016393 CHARMm 0.41704918032786886 COMPASS 0.15737704918032788 COMPASS III 0.04065573770491803 COSMObase 0.0013114754098360656 COSMOconf 0.0045901639344262295 COSMOtherm 0.03934426229508197 Catalyst 0.12459016393442623 Classical Simulations 0.7449180327868853 Crystallization 0.026885245901639345 DFTB Plus 0.0 DMol3 0.09049180327868853 Discover 0.0019672131147540984 Forcite 0.22098360655737706 GULP 0.009836065573770493 Kinetix 0.0 LUDI 0.007213114754098361 LibDock 0.11081967213114755 LigandFit 0.003934426229508197 MCSS 6.557377049180328E-4 MODELER 0.3763934426229508 Mesocite 6.557377049180328E-4 Mesoscale 6.557377049180328E-4 Morphology 0.003934426229508197 Polymorph 0.0013114754098360656 QSAR 0.0 Quantum Mechanics 0.31344262295081965 Reflex 0.020327868852459016 Semi-empirical 6.557377049180328E-4 Sorption 0.02098360655737705 TURBOMOLE 0.0 VAMP 0.0 Visualization 1.0 X-Cell 0.0013114754098360656 ZDOCK 0.0380327868852459

Year

2023 0.002091175240485153 2024 0.4123797574236721 2025 1.0 2026 0.2944374738603095 2027 0.0

Keywords

potential 1.0 target 0.9348274845178414 docking 0.4346800353877912 analysis 0.3232084930698909 visualization 0.24506045414332056 binding 0.17516956649955764 promising 0.15305219699203776 novel 0.1365378944264229 therapeutic 0.13093482748451785 activity 0.09407254497198467 between 0.09053376585078148 protein 0.07372456502506636 including 0.06664700678265999 silico 0.0545561781185491 strong 0.05013270421704512 stability 0.04836331465644353 vitro 0.04806841639634326 development 0.03538779121203185 inhibition 0.03450309643173105 compound 0.031259215570628135 treatment 0.03096431731052787 drug 0.0238867590681215 interaction 0.016809200825715128 effective 0.015629607785314067 synthesized 0.0
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