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

Docking Result

CHEMBL3929146_dpp4

Atoms: 252
Models: 9
Best Energy: -8.384 kcal/mol

Binding Energies:
  • Pose 1: -8.384 kcal/mol
  • Pose 2: -8.044 kcal/mol
  • Pose 3: -7.942 kcal/mol
  • Pose 4: -7.871 kcal/mol
  • Pose 5: -7.767 kcal/mol
  • Pose 6: -7.738 kcal/mol
  • Pose 7: -7.721 kcal/mol
  • Pose 8: -7.699 kcal/mol
  • Pose 9: -7.686 kcal/mol
CHEMBL3929146_dpp4
Energy Plot
RMSD Scatter Plot