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

Docking Result

ligand_39_insr

Atoms: 261
Models: 9
Best Energy: -9.225 kcal/mol

Binding Energies:
  • Pose 1: -9.225 kcal/mol
  • Pose 2: -9.188 kcal/mol
  • Pose 3: -8.951 kcal/mol
  • Pose 4: -8.923 kcal/mol
  • Pose 5: -8.906 kcal/mol
  • Pose 6: -8.863 kcal/mol
  • Pose 7: -8.862 kcal/mol
  • Pose 8: -8.786 kcal/mol
  • Pose 9: -8.729 kcal/mol
ligand_39_insr
Energy Plot
RMSD Scatter Plot