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

Docking Result

CHEMBL255492_dpp4

Atoms: 315
Models: 9
Best Energy: -8.547 kcal/mol

Binding Energies:
  • Pose 1: -8.547 kcal/mol
  • Pose 2: -8.417 kcal/mol
  • Pose 3: -8.36 kcal/mol
  • Pose 4: -8.102 kcal/mol
  • Pose 5: -8.037 kcal/mol
  • Pose 6: -8.016 kcal/mol
  • Pose 7: -8.004 kcal/mol
  • Pose 8: -7.999 kcal/mol
  • Pose 9: -7.931 kcal/mol
CHEMBL255492_dpp4
Energy Plot
RMSD Scatter Plot