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

Docking Result

CHEMBL5279548_dpp4

Atoms: 261
Models: 9
Best Energy: -8.533 kcal/mol

Binding Energies:
  • Pose 1: -8.533 kcal/mol
  • Pose 2: -8.492 kcal/mol
  • Pose 3: -8.472 kcal/mol
  • Pose 4: -8.386 kcal/mol
  • Pose 5: -8.124 kcal/mol
  • Pose 6: -8.12 kcal/mol
  • Pose 7: -8.072 kcal/mol
  • Pose 8: -7.996 kcal/mol
  • Pose 9: -7.784 kcal/mol
CHEMBL5279548_dpp4
Energy Plot
RMSD Scatter Plot