Molecular Docking, Dynamics Simulations, ADMET, and DFT Calculations: Combined <i>In Silico</i> Approach to Screen Natural Inhibitors of 3CL and PL Proteases of SARS-CoV-2

<div>Docking scores of ligands with PL protease of SARS-CoV-2.</div>

Cellular Microbiology

fig6

Figure 6

Figure 6: Molecular Docking, Dynamics Simulations, ADMET, and DFT Calculations: Combined <i>In Silico</i> Approach to Screen Natural Inhibitors of 3CL and PL Proteases of SARS-CoV-2 

Figure 6 | Molecular Docking, Dynamics Simulations, ADMET, and DFT Calculations: Combined In Silico Approach to Screen Natural Inhibitors of 3CL and PL Proteases of SARS-CoV-2 