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

Docking Result

CHEMBL362922_dpp4

Atoms: 207
Models: 9
Best Energy: -6.929 kcal/mol

Binding Energies:
  • Pose 1: -6.929 kcal/mol
  • Pose 2: -6.904 kcal/mol
  • Pose 3: -6.687 kcal/mol
  • Pose 4: -6.67 kcal/mol
  • Pose 5: -6.508 kcal/mol
  • Pose 6: -6.432 kcal/mol
  • Pose 7: -6.371 kcal/mol
  • Pose 8: -6.247 kcal/mol
  • Pose 9: -6.219 kcal/mol
CHEMBL362922_dpp4
Energy Plot
RMSD Scatter Plot