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. 2020 Jul 8:1–15. doi: 10.1080/07391102.2020.1790038

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Figure 10. — The energetic contribution of individual residues from all three complexes to binding energy in kJ/mol for 100 ns MD simulation, (A) all residue contribution of the M^pro-X77 (control) complex in the binding energy (kJ/mol). (B) all residue contribution of the M^pro-22 complex in the binding energy (kJ/mol) and (C) all residue contribution of the M^pro-26 complex in the binding energy (kJ/mol).