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

Docking Result

CHEMBL1243092_dpp4

Atoms: 225
Models: 9
Best Energy: -7.674 kcal/mol

Binding Energies:
  • Pose 1: -7.674 kcal/mol
  • Pose 2: -7.53 kcal/mol
  • Pose 3: -7.422 kcal/mol
  • Pose 4: -7.237 kcal/mol
  • Pose 5: -7.173 kcal/mol
  • Pose 6: -7.139 kcal/mol
  • Pose 7: -7.137 kcal/mol
  • Pose 8: -6.993 kcal/mol
  • Pose 9: -6.869 kcal/mol
CHEMBL1243092_dpp4
Energy Plot
RMSD Scatter Plot