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

Docking Result

ligand_115_insr

Atoms: 171
Models: 9
Best Energy: -6.783 kcal/mol

Binding Energies:
  • Pose 1: -6.783 kcal/mol
  • Pose 2: -6.679 kcal/mol
  • Pose 3: -6.55 kcal/mol
  • Pose 4: -6.483 kcal/mol
  • Pose 5: -6.413 kcal/mol
  • Pose 6: -6.404 kcal/mol
  • Pose 7: -6.345 kcal/mol
  • Pose 8: -6.296 kcal/mol
  • Pose 9: -6.024 kcal/mol
ligand_115_insr
Energy Plot
RMSD Scatter Plot