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

Docking Result

CHEMBL361551_dpp4

Atoms: 216
Models: 9
Best Energy: -8.358 kcal/mol

Binding Energies:
  • Pose 1: -8.358 kcal/mol
  • Pose 2: -8.087 kcal/mol
  • Pose 3: -7.962 kcal/mol
  • Pose 4: -7.688 kcal/mol
  • Pose 5: -7.503 kcal/mol
  • Pose 6: -7.49 kcal/mol
  • Pose 7: -7.461 kcal/mol
  • Pose 8: -7.332 kcal/mol
  • Pose 9: -7.302 kcal/mol
CHEMBL361551_dpp4
Energy Plot
RMSD Scatter Plot