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

Docking Result

CHEMBL3357777_dpp4

Atoms: 315
Models: 9
Best Energy: -8.115 kcal/mol

Binding Energies:
  • Pose 1: -8.115 kcal/mol
  • Pose 2: -7.849 kcal/mol
  • Pose 3: -7.805 kcal/mol
  • Pose 4: -7.803 kcal/mol
  • Pose 5: -7.565 kcal/mol
  • Pose 6: -7.557 kcal/mol
  • Pose 7: -7.477 kcal/mol
  • Pose 8: -7.463 kcal/mol
  • Pose 9: -7.435 kcal/mol
CHEMBL3357777_dpp4
Energy Plot
RMSD Scatter Plot