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

Docking Result

CHEMBL5283569_dpp4

Atoms: 279
Models: 9
Best Energy: -8.478 kcal/mol

Binding Energies:
  • Pose 1: -8.478 kcal/mol
  • Pose 2: -8.448 kcal/mol
  • Pose 3: -8.326 kcal/mol
  • Pose 4: -8.276 kcal/mol
  • Pose 5: -8.232 kcal/mol
  • Pose 6: -8.143 kcal/mol
  • Pose 7: -7.999 kcal/mol
  • Pose 8: -7.96 kcal/mol
  • Pose 9: -7.901 kcal/mol
CHEMBL5283569_dpp4
Energy Plot
RMSD Scatter Plot