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Application

Discovery Studio 1.0 Materials Studio 0.32084309133489464 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.041158536585365856 Amorphous Cell 0.10823170731707317 Blends 0.0 CASTEP 0.21036585365853658 CDOCKER 0.23628048780487804 CHARMm 0.4222560975609756 COMPASS 0.1722560975609756 COMPASS III 0.039634146341463415 COSMObase 0.001524390243902439 COSMOconf 0.003048780487804878 COSMOtherm 0.04725609756097561 Catalyst 0.10518292682926829 Classical Simulations 0.7621951219512195 Crystallization 0.03201219512195122 DFTB Plus 0.0 DMol3 0.10518292682926829 Discover 0.004573170731707317 Forcite 0.22713414634146342 GULP 0.006097560975609756 Kinetix 0.0 LUDI 0.006097560975609756 LibDock 0.12347560975609756 LigandFit 0.004573170731707317 MODELER 0.3978658536585366 Morphology 0.004573170731707317 Polymorph 0.003048780487804878 Quantum Mechanics 0.3094512195121951 Reflex 0.021341463414634148 Semi-empirical 0.0 Sorption 0.024390243902439025 Visualization 1.0 X-Cell 0.001524390243902439 ZDOCK 0.039634146341463415

Year

2024 0.21869488536155202 2025 1.0 2026 0.3544973544973545 2027 0.0

Keywords

potential 1.0 target 0.918809201623816 docking 0.43504736129905275 analysis 0.3267929634641407 visualization 0.2368064952638701 binding 0.18403247631935046 promising 0.16779431664411368 novel 0.15223274695534506 therapeutic 0.14749661705006767 between 0.08930987821380243 activity 0.08795669824086604 including 0.08660351826792964 strong 0.06901217861975643 protein 0.058186738836265225 silico 0.052097428958051424 stability 0.044654939106901215 development 0.04262516914749662 vitro 0.037889039242219216 treatment 0.03112313937753721 drug 0.029093369418132613 inhibition 0.028416779431664412 effective 0.02435723951285521 interaction 0.016914749661705007 compound 0.015561569688768605 synthesized 0.0
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