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

Docking Result

CHEMBL3093896_dpp4

Atoms: 189
Models: 9
Best Energy: -6.828 kcal/mol

Binding Energies:
  • Pose 1: -6.828 kcal/mol
  • Pose 2: -6.746 kcal/mol
  • Pose 3: -6.675 kcal/mol
  • Pose 4: -6.592 kcal/mol
  • Pose 5: -6.519 kcal/mol
  • Pose 6: -6.293 kcal/mol
  • Pose 7: -6.281 kcal/mol
  • Pose 8: -6.238 kcal/mol
  • Pose 9: -6.098 kcal/mol
CHEMBL3093896_dpp4
Energy Plot
RMSD Scatter Plot