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

Docking Result

CHEMBL2022511_dpp4

Atoms: 198
Models: 9
Best Energy: -7.075 kcal/mol

Binding Energies:
  • Pose 1: -7.075 kcal/mol
  • Pose 2: -7.024 kcal/mol
  • Pose 3: -7.01 kcal/mol
  • Pose 4: -6.847 kcal/mol
  • Pose 5: -6.79 kcal/mol
  • Pose 6: -6.581 kcal/mol
  • Pose 7: -6.557 kcal/mol
  • Pose 8: -6.541 kcal/mol
  • Pose 9: -6.516 kcal/mol
CHEMBL2022511_dpp4
Energy Plot
RMSD Scatter Plot