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

Docking Result

CHEMBL256625_dpp4

Atoms: 189
Models: 9
Best Energy: -7.446 kcal/mol

Binding Energies:
  • Pose 1: -7.446 kcal/mol
  • Pose 2: -6.651 kcal/mol
  • Pose 3: -6.5 kcal/mol
  • Pose 4: -6.454 kcal/mol
  • Pose 5: -6.4 kcal/mol
  • Pose 6: -6.225 kcal/mol
  • Pose 7: -6.185 kcal/mol
  • Pose 8: -6.17 kcal/mol
  • Pose 9: -6.154 kcal/mol
CHEMBL256625_dpp4
Energy Plot
RMSD Scatter Plot