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

Docking Result

CHEMBL319350_dpp4

Atoms: 234
Models: 9
Best Energy: -6.929 kcal/mol

Binding Energies:
  • Pose 1: -6.929 kcal/mol
  • Pose 2: -6.846 kcal/mol
  • Pose 3: -6.696 kcal/mol
  • Pose 4: -6.61 kcal/mol
  • Pose 5: -6.609 kcal/mol
  • Pose 6: -6.576 kcal/mol
  • Pose 7: -6.561 kcal/mol
  • Pose 8: -6.558 kcal/mol
  • Pose 9: -6.48 kcal/mol
CHEMBL319350_dpp4
Energy Plot
RMSD Scatter Plot