Table 3.

Average values of the RMSD and RMSF for the simulated systems.

System	RMSD* (nm)	RMSF* (nm)
Unligated Mpro	0.297 ± 0.0531	0.1825 ± 0.0248
Mpro-N3	0.249 ± 0.0438	0.1463 ± 0.0219
Mpro-lopinavir	0.364 ± 0.0572	0.1836 ± 0.0318
Mpro-amentoflavone	0.248 ± 0.0418	0.1372 ± 0.0219
Mpro-bilobetin	0.279 ± 0.0446	0.1413 ± 0.0312
Mpro-ginkgetin	0.246 ± 0.0414	0.1334 ± 0.0246

^*For obtaining the average value, 5 independent MD trajectories were analyzed with the aid of RMSD and RMSF.