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

Docking Result

CHEMBL237758_dpp4

Atoms: 234
Models: 9
Best Energy: -8.696 kcal/mol

Binding Energies:
  • Pose 1: -8.696 kcal/mol
  • Pose 2: -8.554 kcal/mol
  • Pose 3: -8.546 kcal/mol
  • Pose 4: -8.516 kcal/mol
  • Pose 5: -8.379 kcal/mol
  • Pose 6: -8.183 kcal/mol
  • Pose 7: -8.16 kcal/mol
  • Pose 8: -8.103 kcal/mol
  • Pose 9: -8.099 kcal/mol
CHEMBL237758_dpp4
Energy Plot
RMSD Scatter Plot