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

Docking Result

CHEMBL5270959_dpp4

Atoms: 270
Models: 9
Best Energy: -7.587 kcal/mol

Binding Energies:
  • Pose 1: -7.587 kcal/mol
  • Pose 2: -7.582 kcal/mol
  • Pose 3: -7.309 kcal/mol
  • Pose 4: -7.198 kcal/mol
  • Pose 5: -7.187 kcal/mol
  • Pose 6: -7.177 kcal/mol
  • Pose 7: -7.041 kcal/mol
  • Pose 8: -6.997 kcal/mol
  • Pose 9: -6.907 kcal/mol
CHEMBL5270959_dpp4
Energy Plot
RMSD Scatter Plot