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

Docking Result

CHEMBL396136_dpp4

Atoms: 225
Models: 9
Best Energy: -6.642 kcal/mol

Binding Energies:
  • Pose 1: -6.642 kcal/mol
  • Pose 2: -6.606 kcal/mol
  • Pose 3: -6.434 kcal/mol
  • Pose 4: -6.412 kcal/mol
  • Pose 5: -6.326 kcal/mol
  • Pose 6: -6.049 kcal/mol
  • Pose 7: -6.018 kcal/mol
  • Pose 8: -5.731 kcal/mol
  • Pose 9: -5.687 kcal/mol
CHEMBL396136_dpp4
Energy Plot
RMSD Scatter Plot