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

Docking Result

CHEMBL1683118_dpp4

Atoms: 270
Models: 9
Best Energy: -9.035 kcal/mol

Binding Energies:
  • Pose 1: -9.035 kcal/mol
  • Pose 2: -8.911 kcal/mol
  • Pose 3: -8.712 kcal/mol
  • Pose 4: -8.026 kcal/mol
  • Pose 5: -7.891 kcal/mol
  • Pose 6: -7.883 kcal/mol
  • Pose 7: -7.869 kcal/mol
  • Pose 8: -7.855 kcal/mol
  • Pose 9: -7.853 kcal/mol
CHEMBL1683118_dpp4
Energy Plot
RMSD Scatter Plot