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

Docking Result

CHEMBL3680635_dpp4

Atoms: 405
Models: 9
Best Energy: -8.971 kcal/mol

Binding Energies:
  • Pose 1: -8.971 kcal/mol
  • Pose 2: -8.761 kcal/mol
  • Pose 3: -8.223 kcal/mol
  • Pose 4: -8.111 kcal/mol
  • Pose 5: -7.824 kcal/mol
  • Pose 6: -7.798 kcal/mol
  • Pose 7: -7.738 kcal/mol
  • Pose 8: -7.555 kcal/mol
  • Pose 9: -7.442 kcal/mol
CHEMBL3680635_dpp4
Energy Plot
RMSD Scatter Plot