Title : Pomegranate peel polyphenols prophylaxis against SARS-CoV-2 main protease by in-silico docking and molecular dynamics study.

Pub. Date : 2021 Sep 27

PMID : 34569409






1 Functional Relationships(s)
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1 Further, molecular dynamics simulations (200 ns) for Mpro-polyphenols including pelargonidin3-glucoside, quercetin3-O-rhamnoside, cyanidin3-glucoside and punicalin revealed highly stable complexes with less conformational fluctuations and similar degree of compactness. cyanidin-3-o-glucoside NEWENTRY Severe acute respiratory syndrome-related coronavirus