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

Docking Result

CHEMBL3644788_dpp4

Atoms: 342
Models: 9
Best Energy: -8.877 kcal/mol

Binding Energies:
  • Pose 1: -8.877 kcal/mol
  • Pose 2: -8.801 kcal/mol
  • Pose 3: -8.583 kcal/mol
  • Pose 4: -8.543 kcal/mol
  • Pose 5: -8.473 kcal/mol
  • Pose 6: -8.369 kcal/mol
  • Pose 7: -8.35 kcal/mol
  • Pose 8: -8.251 kcal/mol
  • Pose 9: -8.227 kcal/mol
CHEMBL3644788_dpp4
Energy Plot
RMSD Scatter Plot