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

Docking Result

CHEMBL5273881_dpp4

Atoms: 198
Models: 9
Best Energy: -7.013 kcal/mol

Binding Energies:
  • Pose 1: -7.013 kcal/mol
  • Pose 2: -6.934 kcal/mol
  • Pose 3: -6.755 kcal/mol
  • Pose 4: -6.739 kcal/mol
  • Pose 5: -6.701 kcal/mol
  • Pose 6: -6.28 kcal/mol
  • Pose 7: -6.274 kcal/mol
  • Pose 8: -6.266 kcal/mol
  • Pose 9: -6.257 kcal/mol
CHEMBL5273881_dpp4
Energy Plot
RMSD Scatter Plot