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

Docking Result

CHEMBL2159192_dpp4

Atoms: 279
Models: 9
Best Energy: -7.785 kcal/mol

Binding Energies:
  • Pose 1: -7.785 kcal/mol
  • Pose 2: -7.748 kcal/mol
  • Pose 3: -7.437 kcal/mol
  • Pose 4: -7.218 kcal/mol
  • Pose 5: -6.911 kcal/mol
  • Pose 6: -6.746 kcal/mol
  • Pose 7: -6.703 kcal/mol
  • Pose 8: -6.569 kcal/mol
  • Pose 9: -6.485 kcal/mol
CHEMBL2159192_dpp4
Energy Plot
RMSD Scatter Plot