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

Docking Result

ligand_112_insr

Atoms: 162
Models: 9
Best Energy: -7.45 kcal/mol

Binding Energies:
  • Pose 1: -7.45 kcal/mol
  • Pose 2: -7.219 kcal/mol
  • Pose 3: -6.959 kcal/mol
  • Pose 4: -6.909 kcal/mol
  • Pose 5: -6.879 kcal/mol
  • Pose 6: -6.853 kcal/mol
  • Pose 7: -6.827 kcal/mol
  • Pose 8: -6.66 kcal/mol
  • Pose 9: -6.584 kcal/mol
ligand_112_insr
Energy Plot
RMSD Scatter Plot