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

Docking Result

ligand_40_insr

Atoms: 234
Models: 9
Best Energy: -9.143 kcal/mol

Binding Energies:
  • Pose 1: -9.143 kcal/mol
  • Pose 2: -8.925 kcal/mol
  • Pose 3: -8.909 kcal/mol
  • Pose 4: -8.815 kcal/mol
  • Pose 5: -8.76 kcal/mol
  • Pose 6: -8.679 kcal/mol
  • Pose 7: -8.406 kcal/mol
  • Pose 8: -8.325 kcal/mol
  • Pose 9: -8.182 kcal/mol
ligand_40_insr
Energy Plot
RMSD Scatter Plot