Title : An insight into the inhibitory mechanism of phytochemicals and FDA-approved drugs on the ACE2-Spike complex of SARS-CoV-2 using computational methods.

Pub. Date : 2021 May 8

PMID : 33994655






1 Functional Relationships(s)
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1 The MD simulations of ligand-free, Rutin DAB10-bound, and Swertiapuniside-bound ACE2-Spike complex revealed abrogation of the hydrogen bonding network between the two proteins. Hydrogen surface glycoprotein Severe acute respiratory syndrome coronavirus 2