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

Docking Result

CHEMBL485123_dpp4

Atoms: 270
Models: 9
Best Energy: -8.792 kcal/mol

Binding Energies:
  • Pose 1: -8.792 kcal/mol
  • Pose 2: -8.548 kcal/mol
  • Pose 3: -8.455 kcal/mol
  • Pose 4: -8.402 kcal/mol
  • Pose 5: -8.168 kcal/mol
  • Pose 6: -8.151 kcal/mol
  • Pose 7: -8.052 kcal/mol
  • Pose 8: -7.986 kcal/mol
  • Pose 9: -7.927 kcal/mol
CHEMBL485123_dpp4
Energy Plot
RMSD Scatter Plot