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

Docking Result

CHEMBL5269746_dpp4

Atoms: 378
Models: 9
Best Energy: -9.127 kcal/mol

Binding Energies:
  • Pose 1: -9.127 kcal/mol
  • Pose 2: -8.819 kcal/mol
  • Pose 3: -8.763 kcal/mol
  • Pose 4: -8.642 kcal/mol
  • Pose 5: -8.556 kcal/mol
  • Pose 6: -8.537 kcal/mol
  • Pose 7: -8.462 kcal/mol
  • Pose 8: -8.394 kcal/mol
  • Pose 9: -8.324 kcal/mol
CHEMBL5269746_dpp4
Energy Plot
RMSD Scatter Plot