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

Docking Result

CHEMBL373665_dpp4

Atoms: 243
Models: 9
Best Energy: -7.689 kcal/mol

Binding Energies:
  • Pose 1: -7.689 kcal/mol
  • Pose 2: -7.455 kcal/mol
  • Pose 3: -7.454 kcal/mol
  • Pose 4: -7.44 kcal/mol
  • Pose 5: -7.356 kcal/mol
  • Pose 6: -7.202 kcal/mol
  • Pose 7: -7.182 kcal/mol
  • Pose 8: -7.17 kcal/mol
  • Pose 9: -7.128 kcal/mol
CHEMBL373665_dpp4
Energy Plot
RMSD Scatter Plot