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

Docking Result

CHEMBL2425884_dpp4

Atoms: 252
Models: 9
Best Energy: -7.355 kcal/mol

Binding Energies:
  • Pose 1: -7.355 kcal/mol
  • Pose 2: -7.245 kcal/mol
  • Pose 3: -6.863 kcal/mol
  • Pose 4: -6.808 kcal/mol
  • Pose 5: -6.641 kcal/mol
  • Pose 6: -6.623 kcal/mol
  • Pose 7: -6.613 kcal/mol
  • Pose 8: -6.577 kcal/mol
  • Pose 9: -6.418 kcal/mol
CHEMBL2425884_dpp4
Energy Plot
RMSD Scatter Plot