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

Docking Result

CHEMBL4555157_dpp4

Atoms: 171
Models: 9
Best Energy: -6.322 kcal/mol

Binding Energies:
  • Pose 1: -6.322 kcal/mol
  • Pose 2: -6.266 kcal/mol
  • Pose 3: -5.998 kcal/mol
  • Pose 4: -5.979 kcal/mol
  • Pose 5: -5.829 kcal/mol
  • Pose 6: -5.756 kcal/mol
  • Pose 7: -5.73 kcal/mol
  • Pose 8: -5.591 kcal/mol
  • Pose 9: -5.483 kcal/mol
CHEMBL4555157_dpp4
Energy Plot
RMSD Scatter Plot