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

Docking Result

CHEMBL218289_dpp4

Atoms: 243
Models: 9
Best Energy: -8.013 kcal/mol

Binding Energies:
  • Pose 1: -8.013 kcal/mol
  • Pose 2: -7.999 kcal/mol
  • Pose 3: -7.646 kcal/mol
  • Pose 4: -7.506 kcal/mol
  • Pose 5: -7.453 kcal/mol
  • Pose 6: -7.43 kcal/mol
  • Pose 7: -7.113 kcal/mol
  • Pose 8: -7.107 kcal/mol
  • Pose 9: -6.916 kcal/mol
CHEMBL218289_dpp4
Energy Plot
RMSD Scatter Plot