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

Docking Result

CHEMBL192165_dpp4

Atoms: 225
Models: 9
Best Energy: -7.427 kcal/mol

Binding Energies:
  • Pose 1: -7.427 kcal/mol
  • Pose 2: -7.357 kcal/mol
  • Pose 3: -7.141 kcal/mol
  • Pose 4: -7.072 kcal/mol
  • Pose 5: -7.048 kcal/mol
  • Pose 6: -6.988 kcal/mol
  • Pose 7: -6.932 kcal/mol
  • Pose 8: -6.828 kcal/mol
  • Pose 9: -6.775 kcal/mol
CHEMBL192165_dpp4
Energy Plot
RMSD Scatter Plot