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

Docking Result

CHEMBL5421476_dpp4

Atoms: 306
Models: 9
Best Energy: -8.343 kcal/mol

Binding Energies:
  • Pose 1: -8.343 kcal/mol
  • Pose 2: -8.228 kcal/mol
  • Pose 3: -8.093 kcal/mol
  • Pose 4: -8.026 kcal/mol
  • Pose 5: -7.992 kcal/mol
  • Pose 6: -7.951 kcal/mol
  • Pose 7: -7.797 kcal/mol
  • Pose 8: -7.577 kcal/mol
  • Pose 9: -7.464 kcal/mol
CHEMBL5421476_dpp4
Energy Plot
RMSD Scatter Plot