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Application

Discovery Studio 1.0 Materials Studio 0.013535031847133758 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.003215434083601286 CASTEP 0.001607717041800643 CDOCKER 0.2459807073954984 CHARMm 0.4212218649517685 COMPASS III 0.00482315112540193 COSMOtherm 0.001607717041800643 Catalyst 0.13665594855305466 Classical Simulations 0.43086816720257237 Crystallization 0.001607717041800643 DMol3 0.008038585209003215 Forcite 0.003215434083601286 LUDI 0.00482315112540193 LibDock 0.09807073954983923 LigandFit 0.001607717041800643 MODELER 0.364951768488746 QSAR 0.0 Quantum Mechanics 0.011254019292604502 Reflex 0.001607717041800643 Sorption 0.0 Visualization 1.0 X-Cell 0.001607717041800643 ZDOCK 0.03536977491961415

Year

2024 0.13526119402985073 2025 1.0 2026 0.0

Keywords

docking 1.0 target 0.9579256360078278 potential 0.550880626223092 analysis 0.3972602739726027 visualization 0.363013698630137 binding 0.337573385518591 activity 0.17416829745596868 novel 0.12818003913894324 promising 0.12035225048923678 therapeutic 0.11545988258317025 protein 0.10763209393346379 silico 0.09295499021526418 compound 0.07534246575342465 strong 0.07240704500978473 inhibition 0.07045009784735812 vitro 0.06457925636007827 between 0.05185909980430528 interaction 0.04207436399217221 synthesis 0.03522504892367906 including 0.03424657534246575 synthesized 0.03131115459882583 drug 0.016634050880626222 stability 0.0136986301369863 treatment 9.784735812133072E-4 development 0.0
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