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

Docking Result

ligand_172_insr

Atoms: 360
Models: 9
Best Energy: -9.837 kcal/mol

Binding Energies:
  • Pose 1: -9.837 kcal/mol
  • Pose 2: -9.616 kcal/mol
  • Pose 3: -9.613 kcal/mol
  • Pose 4: -9.492 kcal/mol
  • Pose 5: -9.371 kcal/mol
  • Pose 6: -9.339 kcal/mol
  • Pose 7: -9.318 kcal/mol
  • Pose 8: -9.113 kcal/mol
  • Pose 9: -9.017 kcal/mol
ligand_172_insr
Energy Plot
RMSD Scatter Plot