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

Docking Result

CHEMBL401229_dpp4

Atoms: 324
Models: 9
Best Energy: -8.841 kcal/mol

Binding Energies:
  • Pose 1: -8.841 kcal/mol
  • Pose 2: -8.635 kcal/mol
  • Pose 3: -8.432 kcal/mol
  • Pose 4: -8.313 kcal/mol
  • Pose 5: -8.269 kcal/mol
  • Pose 6: -8.217 kcal/mol
  • Pose 7: -8.193 kcal/mol
  • Pose 8: -8.068 kcal/mol
  • Pose 9: -7.978 kcal/mol
CHEMBL401229_dpp4
Energy Plot
RMSD Scatter Plot