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. 2021 Jul 7;118(30):e2024302118. doi: 10.1073/pnas.2024302118

Fig. 2.

Fig. 2.

Molecular docking of drug candidates on Mpro and RdRp. The binding poses of six drugs (including remdesivir) with RdRp-derived structure (PDB 6M71) using AutoDock Vina: (A) omipalisib, (B) remdesivir, (C) tipifarnib, (D) hypericin, (E) LGH-447, and (F) NS-3728. The binding poses of two drugs with Mpro (PDB 6Y2F) using AutoDock Vina: (G) blonanserin and (H) emodin.