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

Docking Result

CHEMBL2069832_dpp4

Atoms: 288
Models: 9
Best Energy: -8.445 kcal/mol

Binding Energies:
  • Pose 1: -8.445 kcal/mol
  • Pose 2: -8.053 kcal/mol
  • Pose 3: -7.952 kcal/mol
  • Pose 4: -7.799 kcal/mol
  • Pose 5: -7.758 kcal/mol
  • Pose 6: -7.569 kcal/mol
  • Pose 7: -7.566 kcal/mol
  • Pose 8: -7.477 kcal/mol
  • Pose 9: -7.407 kcal/mol
CHEMBL2069832_dpp4
Energy Plot
RMSD Scatter Plot