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

Docking Result

CHEMBL1683136_dpp4

Atoms: 234
Models: 9
Best Energy: -8.456 kcal/mol

Binding Energies:
  • Pose 1: -8.456 kcal/mol
  • Pose 2: -8.316 kcal/mol
  • Pose 3: -7.704 kcal/mol
  • Pose 4: -7.626 kcal/mol
  • Pose 5: -7.587 kcal/mol
  • Pose 6: -7.407 kcal/mol
  • Pose 7: -7.301 kcal/mol
  • Pose 8: -7.23 kcal/mol
  • Pose 9: -6.979 kcal/mol
CHEMBL1683136_dpp4
Energy Plot
RMSD Scatter Plot