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

Docking Result

CHEMBL3616905_dpp4

Atoms: 288
Models: 9
Best Energy: -8.815 kcal/mol

Binding Energies:
  • Pose 1: -8.815 kcal/mol
  • Pose 2: -8.36 kcal/mol
  • Pose 3: -8.355 kcal/mol
  • Pose 4: -8.276 kcal/mol
  • Pose 5: -8.226 kcal/mol
  • Pose 6: -8.006 kcal/mol
  • Pose 7: -7.789 kcal/mol
  • Pose 8: -7.735 kcal/mol
  • Pose 9: -7.724 kcal/mol
CHEMBL3616905_dpp4
Energy Plot
RMSD Scatter Plot