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

Docking Result

CHEMBL5424574_dpp4

Atoms: 324
Models: 9
Best Energy: -9.452 kcal/mol

Binding Energies:
  • Pose 1: -9.452 kcal/mol
  • Pose 2: -9.362 kcal/mol
  • Pose 3: -9.318 kcal/mol
  • Pose 4: -9.067 kcal/mol
  • Pose 5: -9.014 kcal/mol
  • Pose 6: -8.735 kcal/mol
  • Pose 7: -8.679 kcal/mol
  • Pose 8: -8.654 kcal/mol
  • Pose 9: -8.424 kcal/mol
CHEMBL5424574_dpp4
Energy Plot
RMSD Scatter Plot