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

Docking Result

CHEMBL288171_dpp4

Atoms: 261
Models: 9
Best Energy: -7.789 kcal/mol

Binding Energies:
  • Pose 1: -7.789 kcal/mol
  • Pose 2: -7.761 kcal/mol
  • Pose 3: -7.728 kcal/mol
  • Pose 4: -7.63 kcal/mol
  • Pose 5: -7.552 kcal/mol
  • Pose 6: -7.462 kcal/mol
  • Pose 7: -7.461 kcal/mol
  • Pose 8: -7.367 kcal/mol
  • Pose 9: -7.338 kcal/mol
CHEMBL288171_dpp4
Energy Plot
RMSD Scatter Plot