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

Docking Result

CHEMBL5624847_dpp4

Atoms: 324
Models: 9
Best Energy: -9.935 kcal/mol

Binding Energies:
  • Pose 1: -9.935 kcal/mol
  • Pose 2: -9.612 kcal/mol
  • Pose 3: -9.13 kcal/mol
  • Pose 4: -9.044 kcal/mol
  • Pose 5: -9.003 kcal/mol
  • Pose 6: -8.881 kcal/mol
  • Pose 7: -8.876 kcal/mol
  • Pose 8: -8.688 kcal/mol
  • Pose 9: -8.552 kcal/mol
CHEMBL5624847_dpp4
Energy Plot
RMSD Scatter Plot