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

Docking Result

CHEMBL4634474_dpp4

Atoms: 333
Models: 9
Best Energy: -8.85 kcal/mol

Binding Energies:
  • Pose 1: -8.85 kcal/mol
  • Pose 2: -8.627 kcal/mol
  • Pose 3: -8.531 kcal/mol
  • Pose 4: -8.503 kcal/mol
  • Pose 5: -8.402 kcal/mol
  • Pose 6: -8.328 kcal/mol
  • Pose 7: -8.191 kcal/mol
  • Pose 8: -8.134 kcal/mol
  • Pose 9: -8.091 kcal/mol
CHEMBL4634474_dpp4
Energy Plot
RMSD Scatter Plot