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

Docking Result

CHEMBL36666_dpp4

Atoms: 252
Models: 9
Best Energy: -8.082 kcal/mol

Binding Energies:
  • Pose 1: -8.082 kcal/mol
  • Pose 2: -7.705 kcal/mol
  • Pose 3: -7.477 kcal/mol
  • Pose 4: -7.33 kcal/mol
  • Pose 5: -7.296 kcal/mol
  • Pose 6: -7.244 kcal/mol
  • Pose 7: -7.224 kcal/mol
  • Pose 8: -7.18 kcal/mol
  • Pose 9: -7.164 kcal/mol
CHEMBL36666_dpp4
Energy Plot
RMSD Scatter Plot