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

Docking Result

ligand_548_insr

Atoms: 342
Models: 9
Best Energy: -10.608 kcal/mol

Binding Energies:
  • Pose 1: -10.608 kcal/mol
  • Pose 2: -10.526 kcal/mol
  • Pose 3: -9.831 kcal/mol
  • Pose 4: -9.713 kcal/mol
  • Pose 5: -9.71 kcal/mol
  • Pose 6: -9.699 kcal/mol
  • Pose 7: -9.565 kcal/mol
  • Pose 8: -9.174 kcal/mol
  • Pose 9: -9.102 kcal/mol
ligand_548_insr
Energy Plot
RMSD Scatter Plot