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

Docking Result

CHEMBL1088406_dpp4

Atoms: 198
Models: 9
Best Energy: -7.337 kcal/mol

Binding Energies:
  • Pose 1: -7.337 kcal/mol
  • Pose 2: -7.299 kcal/mol
  • Pose 3: -7.288 kcal/mol
  • Pose 4: -6.564 kcal/mol
  • Pose 5: -6.454 kcal/mol
  • Pose 6: -6.128 kcal/mol
  • Pose 7: -6.127 kcal/mol
  • Pose 8: -6.094 kcal/mol
  • Pose 9: -6.086 kcal/mol
CHEMBL1088406_dpp4
Energy Plot
RMSD Scatter Plot