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

Docking Result

CHEMBL5267798_dpp4

Atoms: 378
Models: 9
Best Energy: -8.641 kcal/mol

Binding Energies:
  • Pose 1: -8.641 kcal/mol
  • Pose 2: -8.277 kcal/mol
  • Pose 3: -7.868 kcal/mol
  • Pose 4: -7.854 kcal/mol
  • Pose 5: -7.701 kcal/mol
  • Pose 6: -7.563 kcal/mol
  • Pose 7: -7.408 kcal/mol
  • Pose 8: -7.388 kcal/mol
  • Pose 9: -7.326 kcal/mol
CHEMBL5267798_dpp4
Energy Plot
RMSD Scatter Plot