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Application

Discovery Studio 1.0 Materials Studio 0.013485641757893067 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.003962637984715539 Amorphous Cell 0.002547410133031418 CASTEP 0.0011321822813472968 CDOCKER 0.1961505802434192 CHARMm 0.32210585904330596 COMPASS 0.005094820266062836 COMPASS III 0.0022643645626945937 COSMOperm 0.0 COSMOtherm 8.491367110104727E-4 Catalyst 0.1599207472403057 Classical Simulations 0.33654118313048403 Crystallization 0.0016982734220209455 DMol3 0.007642230399094254 Forcite 0.008208321539767903 LUDI 0.003962637984715539 LibDock 0.08915935465609963 LigandFit 0.003962637984715539 MCSS 0.0 MODELER 0.2405887347863006 Polymorph 0.0 QSAR 2.830455703368242E-4 Quantum Mechanics 0.009057458250778375 Reflex 0.001415227851684121 Sorption 5.660911406736484E-4 Visualization 1.0 X-Cell 5.660911406736484E-4 ZDOCK 0.025757146900651003

Year

2022 0.17487046632124353 2023 0.5552677029360967 2024 0.9404145077720207 2025 1.0 2026 0.0

Keywords

docking 1.0 target 0.9687380130418105 potential 0.49002685078634445 visualization 0.45416187188339086 analysis 0.3456079785193709 binding 0.30264672036823936 activity 0.1683927886459532 protein 0.15017261219792866 novel 0.14863828154967396 silico 0.1283084004602992 vitro 0.10970464135021098 compound 0.09627924817798235 drug 0.08381281166091292 between 0.0826620636747219 promising 0.07038741848868431 synthesis 0.06846950517836593 inhibition 0.0682777138473341 therapeutic 0.06635980053701572 interaction 0.06194859992328347 synthesized 0.060030686612965095 treatment 0.02550824702723437 including 0.01611047180667434 potent 0.010356731875719217 stability 0.002685078634445723 development 0.0
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