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

Docking Result

CHEMBL564283_dpp4

Atoms: 288
Models: 9
Best Energy: -7.842 kcal/mol

Binding Energies:
  • Pose 1: -7.842 kcal/mol
  • Pose 2: -7.745 kcal/mol
  • Pose 3: -7.653 kcal/mol
  • Pose 4: -7.424 kcal/mol
  • Pose 5: -7.39 kcal/mol
  • Pose 6: -7.323 kcal/mol
  • Pose 7: -7.294 kcal/mol
  • Pose 8: -7.239 kcal/mol
  • Pose 9: -7.218 kcal/mol
CHEMBL564283_dpp4
Energy Plot
RMSD Scatter Plot