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

Docking Result

ligand_549_insr

Atoms: 279
Models: 9
Best Energy: -9.381 kcal/mol

Binding Energies:
  • Pose 1: -9.381 kcal/mol
  • Pose 2: -9.28 kcal/mol
  • Pose 3: -9.266 kcal/mol
  • Pose 4: -9.089 kcal/mol
  • Pose 5: -9.079 kcal/mol
  • Pose 6: -8.899 kcal/mol
  • Pose 7: -8.867 kcal/mol
  • Pose 8: -8.829 kcal/mol
  • Pose 9: -8.733 kcal/mol
ligand_549_insr
Energy Plot
RMSD Scatter Plot