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

Docking Result

CHEMBL2069850_dpp4

Atoms: 279
Models: 9
Best Energy: -8.521 kcal/mol

Binding Energies:
  • Pose 1: -8.521 kcal/mol
  • Pose 2: -8.067 kcal/mol
  • Pose 3: -7.962 kcal/mol
  • Pose 4: -7.87 kcal/mol
  • Pose 5: -7.815 kcal/mol
  • Pose 6: -7.764 kcal/mol
  • Pose 7: -7.646 kcal/mol
  • Pose 8: -7.604 kcal/mol
  • Pose 9: -7.547 kcal/mol
CHEMBL2069850_dpp4
Energy Plot
RMSD Scatter Plot