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

Docking Result

CHEMBL5429047_dpp4

Atoms: 198
Models: 9
Best Energy: -7.669 kcal/mol

Binding Energies:
  • Pose 1: -7.669 kcal/mol
  • Pose 2: -7.348 kcal/mol
  • Pose 3: -7.174 kcal/mol
  • Pose 4: -7.144 kcal/mol
  • Pose 5: -6.959 kcal/mol
  • Pose 6: -6.865 kcal/mol
  • Pose 7: -6.741 kcal/mol
  • Pose 8: -6.641 kcal/mol
  • Pose 9: -6.626 kcal/mol
CHEMBL5429047_dpp4
Energy Plot
RMSD Scatter Plot