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

Docking Result

CHEMBL3343904_dpp4

Atoms: 288
Models: 9
Best Energy: -7.055 kcal/mol

Binding Energies:
  • Pose 1: -7.055 kcal/mol
  • Pose 2: -6.905 kcal/mol
  • Pose 3: -6.635 kcal/mol
  • Pose 4: -6.613 kcal/mol
  • Pose 5: -6.591 kcal/mol
  • Pose 6: -6.518 kcal/mol
  • Pose 7: -6.415 kcal/mol
  • Pose 8: -6.395 kcal/mol
  • Pose 9: -6.378 kcal/mol
CHEMBL3343904_dpp4
Energy Plot
RMSD Scatter Plot