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

Docking Result

CHEMBL1683089_dpp4

Atoms: 315
Models: 9
Best Energy: -8.439 kcal/mol

Binding Energies:
  • Pose 1: -8.439 kcal/mol
  • Pose 2: -8.408 kcal/mol
  • Pose 3: -8.367 kcal/mol
  • Pose 4: -8.314 kcal/mol
  • Pose 5: -8.253 kcal/mol
  • Pose 6: -8.173 kcal/mol
  • Pose 7: -8.123 kcal/mol
  • Pose 8: -7.924 kcal/mol
  • Pose 9: -7.869 kcal/mol
CHEMBL1683089_dpp4
Energy Plot
RMSD Scatter Plot