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

Docking Result

CHEMBL360167_dpp4

Atoms: 414
Models: 9
Best Energy: -8.533 kcal/mol

Binding Energies:
  • Pose 1: -8.533 kcal/mol
  • Pose 2: -8.449 kcal/mol
  • Pose 3: -8.445 kcal/mol
  • Pose 4: -8.342 kcal/mol
  • Pose 5: -8.29 kcal/mol
  • Pose 6: -8.275 kcal/mol
  • Pose 7: -8.197 kcal/mol
  • Pose 8: -8.189 kcal/mol
  • Pose 9: -8.177 kcal/mol
CHEMBL360167_dpp4
Energy Plot
RMSD Scatter Plot