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

Docking Result

CHEMBL3942798_dpp4

Atoms: 333
Models: 9
Best Energy: -8.918 kcal/mol

Binding Energies:
  • Pose 1: -8.918 kcal/mol
  • Pose 2: -8.915 kcal/mol
  • Pose 3: -8.873 kcal/mol
  • Pose 4: -8.708 kcal/mol
  • Pose 5: -8.661 kcal/mol
  • Pose 6: -8.652 kcal/mol
  • Pose 7: -8.478 kcal/mol
  • Pose 8: -8.436 kcal/mol
  • Pose 9: -8.136 kcal/mol
CHEMBL3942798_dpp4
Energy Plot
RMSD Scatter Plot