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Application

Discovery Studio 1.0 Materials Studio 0.013882532418001525 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0039469974626444885 Amorphous Cell 0.00140964195094446 CASTEP 0.001127713560755568 CDOCKER 0.20693543839864675 CHARMm 0.3490273470538483 COMPASS 0.004792782633211165 COMPASS III 0.0019734987313222443 COSMOtherm 5.63856780377784E-4 Catalyst 0.1621088243586129 Classical Simulations 0.3631237665632929 Crystallization 0.0016915703411333521 DMol3 0.007612066535100085 Forcite 0.00817592331547787 LUDI 0.0053566394135889485 LibDock 0.08937129968987877 LigandFit 0.0031012122920778123 MCSS 2.81928390188892E-4 MODELER 0.2824922469692698 Polymorph 0.0 QSAR 5.63856780377784E-4 Quantum Mechanics 0.009021708486044545 Reflex 0.00140964195094446 Sorption 5.63856780377784E-4 Visualization 1.0 X-Cell 5.63856780377784E-4 ZDOCK 0.025373555117000283

Year

2022 0.0 2023 0.3780607247796278 2024 1.0 2025 0.7793013385569703 2026 0.014038524322559582

Keywords

docking 1.0 target 0.9661987439970448 potential 0.5101588474325822 visualization 0.4290727742888807 analysis 0.3681196896933875 binding 0.3018101219061692 activity 0.17306981898780938 protein 0.15349094939046914 novel 0.1475803472478759 silico 0.12153675655707426 vitro 0.11008496490579978 compound 0.09475434059844846 between 0.08200960472848172 drug 0.07997783524196528 promising 0.07702253417066864 inhibition 0.07536017731806428 therapeutic 0.07018840044329516 synthesis 0.0629848540820096 synthesized 0.05467306981898781 interaction 0.05448836350203177 treatment 0.027151828592537865 including 0.025304765422977465 potent 0.011451791651274473 stability 0.007942371629109716 development 0.0
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