Figure 13

Conformational properties (RMSD, rGyr, intraHB, MolSA, SASA, and PSA) of the potential ligand BPU, outputted during the 100-ns simulated interaction of the compound BPU with the proteins: (A) MMP-2 (PDB ID: 7XGJ). (B) MMP-9 (PDB ID: 2OVX).

Conformational properties (RMSD, rGyr, intraHB, MolSA, SASA, and PSA) of the potential ligand BPU, outputted during the 100-ns simulated interaction of the compound BPU with the proteins: (A) MMP-2 (PDB ID: 7XGJ). (B) MMP-9 (PDB ID: 2OVX).