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

Docking Result

CHEMBL362538_dpp4

Atoms: 405
Models: 9
Best Energy: -8.892 kcal/mol

Binding Energies:
  • Pose 1: -8.892 kcal/mol
  • Pose 2: -8.624 kcal/mol
  • Pose 3: -8.571 kcal/mol
  • Pose 4: -8.522 kcal/mol
  • Pose 5: -8.518 kcal/mol
  • Pose 6: -8.437 kcal/mol
  • Pose 7: -8.393 kcal/mol
  • Pose 8: -8.331 kcal/mol
  • Pose 9: -8.291 kcal/mol
CHEMBL362538_dpp4
Energy Plot
RMSD Scatter Plot