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

Docking Result

CHEMBL5408495_dpp4

Atoms: 243
Models: 9
Best Energy: -7.827 kcal/mol

Binding Energies:
  • Pose 1: -7.827 kcal/mol
  • Pose 2: -7.561 kcal/mol
  • Pose 3: -7.368 kcal/mol
  • Pose 4: -7.326 kcal/mol
  • Pose 5: -7.042 kcal/mol
  • Pose 6: -7.029 kcal/mol
  • Pose 7: -7.002 kcal/mol
  • Pose 8: -6.89 kcal/mol
  • Pose 9: -6.884 kcal/mol
CHEMBL5408495_dpp4
Energy Plot
RMSD Scatter Plot