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

Docking Result

CHEMBL5951803_dpp4

Atoms: 234
Models: 9
Best Energy: -8.269 kcal/mol

Binding Energies:
  • Pose 1: -8.269 kcal/mol
  • Pose 2: -8.248 kcal/mol
  • Pose 3: -7.843 kcal/mol
  • Pose 4: -7.827 kcal/mol
  • Pose 5: -7.564 kcal/mol
  • Pose 6: -7.372 kcal/mol
  • Pose 7: -7.169 kcal/mol
  • Pose 8: -7.07 kcal/mol
  • Pose 9: -7.052 kcal/mol
CHEMBL5951803_dpp4
Energy Plot
RMSD Scatter Plot