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

Docking Result

CHEMBL3904065_dpp4

Atoms: 333
Models: 9
Best Energy: -8.665 kcal/mol

Binding Energies:
  • Pose 1: -8.665 kcal/mol
  • Pose 2: -8.607 kcal/mol
  • Pose 3: -8.559 kcal/mol
  • Pose 4: -8.409 kcal/mol
  • Pose 5: -8.36 kcal/mol
  • Pose 6: -8.213 kcal/mol
  • Pose 7: -8.199 kcal/mol
  • Pose 8: -8.198 kcal/mol
  • Pose 9: -8.174 kcal/mol
CHEMBL3904065_dpp4
Energy Plot
RMSD Scatter Plot