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

Docking Result

CHEMBL2347039_dpp4

Atoms: 315
Models: 9
Best Energy: -8.36 kcal/mol

Binding Energies:
  • Pose 1: -8.36 kcal/mol
  • Pose 2: -8.348 kcal/mol
  • Pose 3: -8.34 kcal/mol
  • Pose 4: -8.136 kcal/mol
  • Pose 5: -8.056 kcal/mol
  • Pose 6: -7.85 kcal/mol
  • Pose 7: -7.731 kcal/mol
  • Pose 8: -7.723 kcal/mol
  • Pose 9: -7.665 kcal/mol
CHEMBL2347039_dpp4
Energy Plot
RMSD Scatter Plot