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

Docking Result

CHEMBL146509_dpp4

Atoms: 171
Models: 9
Best Energy: -5.392 kcal/mol

Binding Energies:
  • Pose 1: -5.392 kcal/mol
  • Pose 2: -5.14 kcal/mol
  • Pose 3: -4.981 kcal/mol
  • Pose 4: -4.914 kcal/mol
  • Pose 5: -4.886 kcal/mol
  • Pose 6: -4.855 kcal/mol
  • Pose 7: -4.787 kcal/mol
  • Pose 8: -4.736 kcal/mol
  • Pose 9: -4.511 kcal/mol
CHEMBL146509_dpp4
Energy Plot
RMSD Scatter Plot