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

Docking Result

CHEMBL5279474_dpp4

Atoms: 387
Models: 9
Best Energy: -9.211 kcal/mol

Binding Energies:
  • Pose 1: -9.211 kcal/mol
  • Pose 2: -8.985 kcal/mol
  • Pose 3: -8.881 kcal/mol
  • Pose 4: -8.708 kcal/mol
  • Pose 5: -8.304 kcal/mol
  • Pose 6: -8.125 kcal/mol
  • Pose 7: -8.095 kcal/mol
  • Pose 8: -8.077 kcal/mol
  • Pose 9: -8.043 kcal/mol
CHEMBL5279474_dpp4
Energy Plot
RMSD Scatter Plot