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

Docking Result

CHEMBL379500_dpp4

Atoms: 216
Models: 9
Best Energy: -8.163 kcal/mol

Binding Energies:
  • Pose 1: -8.163 kcal/mol
  • Pose 2: -8.093 kcal/mol
  • Pose 3: -7.716 kcal/mol
  • Pose 4: -7.511 kcal/mol
  • Pose 5: -7.502 kcal/mol
  • Pose 6: -7.404 kcal/mol
  • Pose 7: -7.345 kcal/mol
  • Pose 8: -7.331 kcal/mol
  • Pose 9: -7.26 kcal/mol
CHEMBL379500_dpp4
Energy Plot
RMSD Scatter Plot