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

Docking Result

CHEMBL2147774_dpp4

Atoms: 297
Models: 9
Best Energy: -8.61 kcal/mol

Binding Energies:
  • Pose 1: -8.61 kcal/mol
  • Pose 2: -8.336 kcal/mol
  • Pose 3: -8.292 kcal/mol
  • Pose 4: -8.234 kcal/mol
  • Pose 5: -8.078 kcal/mol
  • Pose 6: -8.007 kcal/mol
  • Pose 7: -7.986 kcal/mol
  • Pose 8: -7.871 kcal/mol
  • Pose 9: -7.764 kcal/mol
CHEMBL2147774_dpp4
Energy Plot
RMSD Scatter Plot