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Application

Discovery Studio 1.0 Materials Studio 0.5398601398601398 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07096774193548387 Amorphous Cell 0.17667493796526054 Blends 0.001488833746898263 CASTEP 0.3781637717121588 CDOCKER 0.19305210918114143 CHARMm 0.3543424317617866 COMPASS 0.22133995037220844 COMPASS III 0.05260545905707196 COSMObase 0.002977667493796526 COSMOconf 0.0034739454094292804 COSMOmic 0.0 COSMOperm 9.925558312655087E-4 COSMOplex 0.0 COSMOquick 4.962779156327543E-4 COSMOtherm 0.060049627791563275 Catalyst 0.11910669975186104 Classical Simulations 0.824317617866005 Conformers 0.0 Crystallization 0.03076923076923077 DFTB Plus 0.005955334987593052 DMol3 0.13746898263027296 DPD 9.925558312655087E-4 Discover 0.001488833746898263 Forcite 0.32754342431761785 GULP 0.01836228287841191 Kinetix 0.0 LUDI 0.005459057071960298 LibDock 0.09330024813895782 LigandFit 0.001488833746898263 MCSS 0.0 MODELER 0.34590570719602975 MesoDyn 0.0 Mesocite 0.0019851116625310174 Mesoscale 0.0034739454094292804 Modules 0.0 Morphology 0.00794044665012407 Polymorph 9.925558312655087E-4 QMERA 0.0 QSAR 0.001488833746898263 Quantum Mechanics 0.5047146401985112 Reflex 0.018858560794044667 Reflex Plus 4.962779156327543E-4 Semi-empirical 0.0064516129032258064 Sorption 0.03076923076923077 Synthia 4.962779156327543E-4 Visualization 1.0 X-Cell 0.0019851116625310174 ZDOCK 0.03225806451612903

Year

2023 0.12358356940509915 2024 0.6469546742209632 2025 1.0 2026 0.3126770538243626 2027 0.0

Keywords

analysis 1.0 target 0.9290204826607179 potential 0.40620563780166297 docking 0.38369499087406206 visualization 0.21942810788886635 between 0.14581220847698237 binding 0.14337862502534982 novel 0.07929426079902657 promising 0.073615899411884 stability 0.06388156560535388 activity 0.06023119042790509 including 0.0547556276617319 protein 0.05455282904076252 interaction 0.04644088420198743 energy 0.04076252281484486 silico 0.030014195903467857 therapeutic 0.028797404177651593 strong 0.017440681403366458 mechanism 0.009734333806530115 experimental 0.005272764145203813 treatment 0.004867166903265057 vitro 0.003447576556479416 cell 0.0016223889677550193 drug 6.083958629081322E-4 effective 0.0
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