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

Docking Result

CHEMBL5961410_dpp4

Atoms: 387
Models: 9
Best Energy: -10.39 kcal/mol

Binding Energies:
  • Pose 1: -10.39 kcal/mol
  • Pose 2: -9.371 kcal/mol
  • Pose 3: -9.321 kcal/mol
  • Pose 4: -9.202 kcal/mol
  • Pose 5: -9.075 kcal/mol
  • Pose 6: -8.894 kcal/mol
  • Pose 7: -8.771 kcal/mol
  • Pose 8: -8.7 kcal/mol
  • Pose 9: -8.625 kcal/mol
CHEMBL5961410_dpp4
Energy Plot
RMSD Scatter Plot