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Application

Discovery Studio 1.0 Materials Studio 0.4394029850746269 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06229508196721312 Amorphous Cell 0.15027322404371585 Blends 5.46448087431694E-4 CASTEP 0.31311475409836065 CDOCKER 0.20437158469945355 CHARMm 0.3704918032786885 COMPASS 0.1819672131147541 COMPASS III 0.048633879781420766 COSMObase 0.003278688524590164 COSMOconf 0.003278688524590164 COSMOmic 0.0 COSMOperm 5.46448087431694E-4 COSMOquick 0.0 COSMOtherm 0.05136612021857923 Catalyst 0.11202185792349727 Classical Simulations 0.7715846994535519 Conformers 0.0 Crystallization 0.027868852459016394 DFTB Plus 0.003825136612021858 DMol3 0.11256830601092896 DPD 0.0 Discover 0.001092896174863388 Forcite 0.2726775956284153 GULP 0.01639344262295082 LUDI 0.006010928961748634 LibDock 0.09726775956284153 LigandFit 0.001639344262295082 MODELER 0.37158469945355194 Mesocite 0.002185792349726776 Mesoscale 0.00273224043715847 Modules 0.0 Morphology 0.007650273224043716 Polymorph 0.001092896174863388 QMERA 0.0 QSAR 5.46448087431694E-4 Quantum Mechanics 0.41857923497267757 Reflex 0.01639344262295082 Reflex Plus 0.0 Semi-empirical 0.004371584699453552 Sorption 0.02896174863387978 Visualization 1.0 X-Cell 0.002185792349726776 ZDOCK 0.03169398907103825

Year

2023 0.07262103505843072 2024 0.6940734557595993 2025 1.0 2026 0.36811352253756263 2027 0.0

Keywords

analysis 1.0 target 0.9278519559615835 potential 0.4244553759662684 docking 0.42422112907003984 visualization 0.23471539002108222 binding 0.1613961115015226 between 0.13492621222768797 novel 0.08128367299133286 promising 0.08104942609510424 activity 0.07285078472710237 protein 0.06394940267041462 stability 0.061606933708128364 including 0.056453501991098616 therapeutic 0.04544389786835325 interaction 0.044038416490981495 silico 0.03865073787772312 energy 0.020847973764347622 strong 0.019208245490747247 treatment 0.012415085500117124 vitro 0.011712344811431248 mechanism 0.007964394471773249 drug 0.006793159990630124 compound 0.0053876786132583745 inhibition 0.0030452096509721244 effective 0.0
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