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

Docking Result

CHEMBL248795_dpp4

Atoms: 252
Models: 9
Best Energy: -8.032 kcal/mol

Binding Energies:
  • Pose 1: -8.032 kcal/mol
  • Pose 2: -7.88 kcal/mol
  • Pose 3: -7.784 kcal/mol
  • Pose 4: -7.714 kcal/mol
  • Pose 5: -7.675 kcal/mol
  • Pose 6: -7.627 kcal/mol
  • Pose 7: -7.61 kcal/mol
  • Pose 8: -7.414 kcal/mol
  • Pose 9: -7.179 kcal/mol
CHEMBL248795_dpp4
Energy Plot
RMSD Scatter Plot