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

Docking Result

CHEMBL2385276_dpp4

Atoms: 216
Models: 9
Best Energy: -8.377 kcal/mol

Binding Energies:
  • Pose 1: -8.377 kcal/mol
  • Pose 2: -8.094 kcal/mol
  • Pose 3: -7.969 kcal/mol
  • Pose 4: -7.792 kcal/mol
  • Pose 5: -7.786 kcal/mol
  • Pose 6: -7.764 kcal/mol
  • Pose 7: -7.594 kcal/mol
  • Pose 8: -7.545 kcal/mol
  • Pose 9: -7.542 kcal/mol
CHEMBL2385276_dpp4
Energy Plot
RMSD Scatter Plot