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

Docking Result

CHEMBL2069860_dpp4

Atoms: 297
Models: 9
Best Energy: -8.115 kcal/mol

Binding Energies:
  • Pose 1: -8.115 kcal/mol
  • Pose 2: -8.098 kcal/mol
  • Pose 3: -7.922 kcal/mol
  • Pose 4: -7.86 kcal/mol
  • Pose 5: -7.71 kcal/mol
  • Pose 6: -7.707 kcal/mol
  • Pose 7: -7.505 kcal/mol
  • Pose 8: -7.322 kcal/mol
  • Pose 9: -7.293 kcal/mol
CHEMBL2069860_dpp4
Energy Plot
RMSD Scatter Plot