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

Docking Result

CHEMBL368869_dpp4

Atoms: 189
Models: 9
Best Energy: -7.319 kcal/mol

Binding Energies:
  • Pose 1: -7.319 kcal/mol
  • Pose 2: -7.204 kcal/mol
  • Pose 3: -7.13 kcal/mol
  • Pose 4: -7.08 kcal/mol
  • Pose 5: -7.036 kcal/mol
  • Pose 6: -6.927 kcal/mol
  • Pose 7: -6.829 kcal/mol
  • Pose 8: -6.712 kcal/mol
  • Pose 9: -6.66 kcal/mol
CHEMBL368869_dpp4
Energy Plot
RMSD Scatter Plot