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

Docking Result

CHEMBL257795_dpp4

Atoms: 306
Models: 9
Best Energy: -7.902 kcal/mol

Binding Energies:
  • Pose 1: -7.902 kcal/mol
  • Pose 2: -7.709 kcal/mol
  • Pose 3: -7.669 kcal/mol
  • Pose 4: -7.521 kcal/mol
  • Pose 5: -7.519 kcal/mol
  • Pose 6: -7.507 kcal/mol
  • Pose 7: -7.441 kcal/mol
  • Pose 8: -7.375 kcal/mol
  • Pose 9: -7.315 kcal/mol
CHEMBL257795_dpp4
Energy Plot
RMSD Scatter Plot