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

Docking Result

CHEMBL361235_dpp4

Atoms: 198
Models: 9
Best Energy: -8.109 kcal/mol

Binding Energies:
  • Pose 1: -8.109 kcal/mol
  • Pose 2: -7.982 kcal/mol
  • Pose 3: -7.947 kcal/mol
  • Pose 4: -7.878 kcal/mol
  • Pose 5: -7.362 kcal/mol
  • Pose 6: -7.183 kcal/mol
  • Pose 7: -7.039 kcal/mol
  • Pose 8: -6.947 kcal/mol
  • Pose 9: -6.873 kcal/mol
CHEMBL361235_dpp4
Energy Plot
RMSD Scatter Plot