Virtual Screening of Phytochemicals by Targeting HR1 Domain of SARS-CoV-2 S Protein: Molecular Docking, Molecular Dynamics Simulations, and DFT Studies

Figure 2

graphs for complexes of strongly binding phytochemicals with HR1 domain. (a) SilybinC, (b) Isopomiferin, (c) Lycopene, (d) SilydianinB, and (e) Silydianin.

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