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

Docking Result

CHEMBL2178964_dpp4

Atoms: 324
Models: 9
Best Energy: -9.385 kcal/mol

Binding Energies:
  • Pose 1: -9.385 kcal/mol
  • Pose 2: -8.749 kcal/mol
  • Pose 3: -8.732 kcal/mol
  • Pose 4: -8.648 kcal/mol
  • Pose 5: -8.562 kcal/mol
  • Pose 6: -8.482 kcal/mol
  • Pose 7: -8.405 kcal/mol
  • Pose 8: -8.37 kcal/mol
  • Pose 9: -8.333 kcal/mol
CHEMBL2178964_dpp4
Energy Plot
RMSD Scatter Plot