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

Docking Result

CHEMBL1243127_dpp4

Atoms: 270
Models: 9
Best Energy: -8.476 kcal/mol

Binding Energies:
  • Pose 1: -8.476 kcal/mol
  • Pose 2: -8.391 kcal/mol
  • Pose 3: -8.221 kcal/mol
  • Pose 4: -8.073 kcal/mol
  • Pose 5: -7.931 kcal/mol
  • Pose 6: -7.861 kcal/mol
  • Pose 7: -7.855 kcal/mol
  • Pose 8: -7.728 kcal/mol
  • Pose 9: -7.558 kcal/mol
CHEMBL1243127_dpp4
Energy Plot
RMSD Scatter Plot