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

Docking Result

ligand_49_insr

Atoms: 279
Models: 9
Best Energy: -9.727 kcal/mol

Binding Energies:
  • Pose 1: -9.727 kcal/mol
  • Pose 2: -9.388 kcal/mol
  • Pose 3: -9.289 kcal/mol
  • Pose 4: -9.124 kcal/mol
  • Pose 5: -9.048 kcal/mol
  • Pose 6: -9.03 kcal/mol
  • Pose 7: -8.74 kcal/mol
  • Pose 8: -8.455 kcal/mol
  • Pose 9: -8.361 kcal/mol
ligand_49_insr
Energy Plot
RMSD Scatter Plot