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

Docking Result

CHEMBL101656_dpp4

Atoms: 198
Models: 9
Best Energy: -5.633 kcal/mol

Binding Energies:
  • Pose 1: -5.633 kcal/mol
  • Pose 2: -5.429 kcal/mol
  • Pose 3: -5.234 kcal/mol
  • Pose 4: -5.021 kcal/mol
  • Pose 5: -4.987 kcal/mol
  • Pose 6: -4.933 kcal/mol
  • Pose 7: -4.885 kcal/mol
  • Pose 8: -4.854 kcal/mol
  • Pose 9: -4.808 kcal/mol
CHEMBL101656_dpp4
Energy Plot
RMSD Scatter Plot