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

Docking Result

CHEMBL1082463_dpp4

Atoms: 234
Models: 9
Best Energy: -6.469 kcal/mol

Binding Energies:
  • Pose 1: -6.469 kcal/mol
  • Pose 2: -6.381 kcal/mol
  • Pose 3: -6.379 kcal/mol
  • Pose 4: -6.282 kcal/mol
  • Pose 5: -6.266 kcal/mol
  • Pose 6: -6.247 kcal/mol
  • Pose 7: -6.244 kcal/mol
  • Pose 8: -6.224 kcal/mol
  • Pose 9: -6.139 kcal/mol
CHEMBL1082463_dpp4
Energy Plot
RMSD Scatter Plot