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

Docking Result

CHEMBL177265_dpp4

Atoms: 180
Models: 9
Best Energy: -6.889 kcal/mol

Binding Energies:
  • Pose 1: -6.889 kcal/mol
  • Pose 2: -6.858 kcal/mol
  • Pose 3: -6.857 kcal/mol
  • Pose 4: -6.843 kcal/mol
  • Pose 5: -6.778 kcal/mol
  • Pose 6: -6.777 kcal/mol
  • Pose 7: -6.743 kcal/mol
  • Pose 8: -6.742 kcal/mol
  • Pose 9: -6.596 kcal/mol
CHEMBL177265_dpp4
Energy Plot
RMSD Scatter Plot