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

Docking Result

CHEMBL1614729_dpp4

Atoms: 234
Models: 9
Best Energy: -7.282 kcal/mol

Binding Energies:
  • Pose 1: -7.282 kcal/mol
  • Pose 2: -7.27 kcal/mol
  • Pose 3: -6.917 kcal/mol
  • Pose 4: -6.736 kcal/mol
  • Pose 5: -6.607 kcal/mol
  • Pose 6: -6.604 kcal/mol
  • Pose 7: -6.39 kcal/mol
  • Pose 8: -6.319 kcal/mol
  • Pose 9: -6.299 kcal/mol
CHEMBL1614729_dpp4
Energy Plot
RMSD Scatter Plot