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

Docking Result

CHEMBL1779706_dpp4

Atoms: 252
Models: 9
Best Energy: -7.157 kcal/mol

Binding Energies:
  • Pose 1: -7.157 kcal/mol
  • Pose 2: -6.888 kcal/mol
  • Pose 3: -6.822 kcal/mol
  • Pose 4: -6.816 kcal/mol
  • Pose 5: -6.731 kcal/mol
  • Pose 6: -6.73 kcal/mol
  • Pose 7: -6.603 kcal/mol
  • Pose 8: -6.557 kcal/mol
  • Pose 9: -6.462 kcal/mol
CHEMBL1779706_dpp4
Energy Plot
RMSD Scatter Plot