Fig. 4

RMSD trajectories for protein and ligands for the 100 ns simulation (a) RMSD of the protein (b) RMSD of the ligands control, 138,567,123, 5,279,171, and 129,130,827.

RMSD trajectories for protein and ligands for the 100 ns simulation (a) RMSD of the protein (b) RMSD of the ligands control, 138,567,123, 5,279,171, and 129,130,827.