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

Docking Result

CHEMBL3687983_dpp4

Atoms: 333
Models: 9
Best Energy: -8.273 kcal/mol

Binding Energies:
  • Pose 1: -8.273 kcal/mol
  • Pose 2: -8.223 kcal/mol
  • Pose 3: -8.098 kcal/mol
  • Pose 4: -8.008 kcal/mol
  • Pose 5: -8.006 kcal/mol
  • Pose 6: -7.992 kcal/mol
  • Pose 7: -7.843 kcal/mol
  • Pose 8: -7.816 kcal/mol
  • Pose 9: -7.728 kcal/mol
CHEMBL3687983_dpp4
Energy Plot
RMSD Scatter Plot