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

Docking Result

CHEMBL4537708_dpp4

Atoms: 342
Models: 9
Best Energy: -9.829 kcal/mol

Binding Energies:
  • Pose 1: -9.829 kcal/mol
  • Pose 2: -9.655 kcal/mol
  • Pose 3: -9.573 kcal/mol
  • Pose 4: -9.561 kcal/mol
  • Pose 5: -9.334 kcal/mol
  • Pose 6: -9.255 kcal/mol
  • Pose 7: -9.005 kcal/mol
  • Pose 8: -8.911 kcal/mol
  • Pose 9: -8.837 kcal/mol
CHEMBL4537708_dpp4
Energy Plot
RMSD Scatter Plot