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

Docking Result

CHEMBL504506_dpp4

Atoms: 180
Models: 9
Best Energy: -7.474 kcal/mol

Binding Energies:
  • Pose 1: -7.474 kcal/mol
  • Pose 2: -7.309 kcal/mol
  • Pose 3: -7.108 kcal/mol
  • Pose 4: -6.872 kcal/mol
  • Pose 5: -6.815 kcal/mol
  • Pose 6: -6.681 kcal/mol
  • Pose 7: -6.648 kcal/mol
  • Pose 8: -6.591 kcal/mol
  • Pose 9: -6.549 kcal/mol
CHEMBL504506_dpp4
Energy Plot
RMSD Scatter Plot