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

Docking Result

CHEMBL6189534_dpp4

Atoms: 252
Models: 9
Best Energy: -8.459 kcal/mol

Binding Energies:
  • Pose 1: -8.459 kcal/mol
  • Pose 2: -8.127 kcal/mol
  • Pose 3: -7.828 kcal/mol
  • Pose 4: -7.783 kcal/mol
  • Pose 5: -7.69 kcal/mol
  • Pose 6: -7.52 kcal/mol
  • Pose 7: -7.484 kcal/mol
  • Pose 8: -7.463 kcal/mol
  • Pose 9: -7.395 kcal/mol
CHEMBL6189534_dpp4
Energy Plot
RMSD Scatter Plot