DockMetrics
MOLECULAR DOCKING Inhibition Efficiency Index (IEI) and Selectivity Entropy Index (SEI)

Docking Result

CHEMBL474410_dpp4

Atoms: 279
Models: 9
Best Energy: -8.855 kcal/mol

Binding Energies:
  • Pose 1: -8.855 kcal/mol
  • Pose 2: -8.782 kcal/mol
  • Pose 3: -8.459 kcal/mol
  • Pose 4: -8.437 kcal/mol
  • Pose 5: -8.245 kcal/mol
  • Pose 6: -8.116 kcal/mol
  • Pose 7: -8.101 kcal/mol
  • Pose 8: -8.002 kcal/mol
  • Pose 9: -7.98 kcal/mol
CHEMBL474410_dpp4
Energy Plot
RMSD Scatter Plot