Fig. 13

RMSD (A), RMSF (B), Interaction profile (C), rGyr, intraHB, MolSA, SASA, and PSA (D) of the protein and ligand during the MD process.

RMSD (A), RMSF (B), Interaction profile (C), rGyr, intraHB, MolSA, SASA, and PSA (D) of the protein and ligand during the MD process.