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

Docking Result

CHEMBL4446618_dpp4

Atoms: 297
Models: 9
Best Energy: -8.005 kcal/mol

Binding Energies:
  • Pose 1: -8.005 kcal/mol
  • Pose 2: -7.847 kcal/mol
  • Pose 3: -7.757 kcal/mol
  • Pose 4: -7.506 kcal/mol
  • Pose 5: -7.495 kcal/mol
  • Pose 6: -7.417 kcal/mol
  • Pose 7: -7.364 kcal/mol
  • Pose 8: -7.275 kcal/mol
  • Pose 9: -7.243 kcal/mol
CHEMBL4446618_dpp4
Energy Plot
RMSD Scatter Plot