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

Docking Result

CHEMBL6146956_dpp4

Atoms: 279
Models: 9
Best Energy: -8.139 kcal/mol

Binding Energies:
  • Pose 1: -8.139 kcal/mol
  • Pose 2: -8.087 kcal/mol
  • Pose 3: -8.03 kcal/mol
  • Pose 4: -7.968 kcal/mol
  • Pose 5: -7.925 kcal/mol
  • Pose 6: -7.842 kcal/mol
  • Pose 7: -7.585 kcal/mol
  • Pose 8: -7.422 kcal/mol
  • Pose 9: -7.414 kcal/mol
CHEMBL6146956_dpp4
Energy Plot
RMSD Scatter Plot