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

Docking Result

CHEMBL470356_dpp4

Atoms: 342
Models: 9
Best Energy: -8.303 kcal/mol

Binding Energies:
  • Pose 1: -8.303 kcal/mol
  • Pose 2: -8.288 kcal/mol
  • Pose 3: -8.248 kcal/mol
  • Pose 4: -8.153 kcal/mol
  • Pose 5: -8.081 kcal/mol
  • Pose 6: -8.075 kcal/mol
  • Pose 7: -8.035 kcal/mol
  • Pose 8: -7.863 kcal/mol
  • Pose 9: -7.804 kcal/mol
CHEMBL470356_dpp4
Energy Plot
RMSD Scatter Plot