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

Docking Result

CHEMBL367368_dpp4

Atoms: 351
Models: 9
Best Energy: -9.252 kcal/mol

Binding Energies:
  • Pose 1: -9.252 kcal/mol
  • Pose 2: -8.986 kcal/mol
  • Pose 3: -8.89 kcal/mol
  • Pose 4: -8.831 kcal/mol
  • Pose 5: -8.815 kcal/mol
  • Pose 6: -8.646 kcal/mol
  • Pose 7: -8.459 kcal/mol
  • Pose 8: -8.394 kcal/mol
  • Pose 9: -8.241 kcal/mol
CHEMBL367368_dpp4
Energy Plot
RMSD Scatter Plot