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

Docking Result

CHEMBL3236118_dpp4

Atoms: 261
Models: 9
Best Energy: -8.343 kcal/mol

Binding Energies:
  • Pose 1: -8.343 kcal/mol
  • Pose 2: -8.245 kcal/mol
  • Pose 3: -8.224 kcal/mol
  • Pose 4: -8.175 kcal/mol
  • Pose 5: -8.111 kcal/mol
  • Pose 6: -7.988 kcal/mol
  • Pose 7: -7.881 kcal/mol
  • Pose 8: -7.569 kcal/mol
  • Pose 9: -7.566 kcal/mol
CHEMBL3236118_dpp4
Energy Plot
RMSD Scatter Plot