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

Docking Result

CHEMBL1688436_dpp4

Atoms: 261
Models: 9
Best Energy: -7.823 kcal/mol

Binding Energies:
  • Pose 1: -7.823 kcal/mol
  • Pose 2: -7.775 kcal/mol
  • Pose 3: -7.457 kcal/mol
  • Pose 4: -7.364 kcal/mol
  • Pose 5: -7.093 kcal/mol
  • Pose 6: -7.057 kcal/mol
  • Pose 7: -7.029 kcal/mol
  • Pose 8: -6.947 kcal/mol
  • Pose 9: -6.923 kcal/mol
CHEMBL1688436_dpp4
Energy Plot
RMSD Scatter Plot