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

Docking Result

CHEMBL237289_dpp4

Atoms: 369
Models: 9
Best Energy: -8.724 kcal/mol

Binding Energies:
  • Pose 1: -8.724 kcal/mol
  • Pose 2: -8.401 kcal/mol
  • Pose 3: -8.358 kcal/mol
  • Pose 4: -8.322 kcal/mol
  • Pose 5: -8.307 kcal/mol
  • Pose 6: -8.204 kcal/mol
  • Pose 7: -8.171 kcal/mol
  • Pose 8: -8.041 kcal/mol
  • Pose 9: -7.938 kcal/mol
CHEMBL237289_dpp4
Energy Plot
RMSD Scatter Plot