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

Docking Result

CHEMBL236922_dpp4

Atoms: 279
Models: 9
Best Energy: -8.938 kcal/mol

Binding Energies:
  • Pose 1: -8.938 kcal/mol
  • Pose 2: -8.842 kcal/mol
  • Pose 3: -8.787 kcal/mol
  • Pose 4: -8.772 kcal/mol
  • Pose 5: -8.649 kcal/mol
  • Pose 6: -8.637 kcal/mol
  • Pose 7: -8.616 kcal/mol
  • Pose 8: -8.55 kcal/mol
  • Pose 9: -8.52 kcal/mol
CHEMBL236922_dpp4
Energy Plot
RMSD Scatter Plot