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

Docking Result

CHEMBL4789426_dpp4

Atoms: 225
Models: 9
Best Energy: -8.094 kcal/mol

Binding Energies:
  • Pose 1: -8.094 kcal/mol
  • Pose 2: -8.084 kcal/mol
  • Pose 3: -7.73 kcal/mol
  • Pose 4: -7.72 kcal/mol
  • Pose 5: -7.627 kcal/mol
  • Pose 6: -7.471 kcal/mol
  • Pose 7: -7.4 kcal/mol
  • Pose 8: -7.292 kcal/mol
  • Pose 9: -7.228 kcal/mol
CHEMBL4789426_dpp4
Energy Plot
RMSD Scatter Plot