Table 3. Comparison of the MD Simulation Statistics of the Native CoV2-RdRp and Small Molecule-Bound CoV2-RdRp Complexes for 50 ns.

NAME	RMSD (Å)	RMSF (Å)	SASA (Å2)	H-bonds
native RdRp	7.5−10	aa1-aa50: 10–17.5 remaining aa: <10	23,000–26,000	NA
RdRp-GTP	5−12.5	aa1-aa50: 10–20 aa700-aa800: 5	40,000–48,000	15 (0–5 ns); 8 (6–50 ns)
RdRp-FIH	5	aa1-aa50: 5 remaining aa: <2.5	42,000–45,000	4 (0–50 ns)
RdRp-lead	5−10	aa1-aa50: 10 remaining aa: <7.5	41,000–44,000	5 (0–50 ns)