Fig. 2.
Top: Comparison of RMSF (root-mean-square fluctuation) (Å) of CA atoms in MD structure of Mpro-native (violet), HCQ (red), indacaterol (green), and ZINC28706440 (blue) bound form. The final 25,000 frames for each conformation were used. Bottom: Comparison of RMSD (root-mean-square deviation) (Å) of CA atoms in MD structure of Mpro-native (violet), HCQ (red), indacaterol (green), and ZINC28706440 (blue) bound form.