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

Docking Result

ligand_99_insr

Atoms: 243
Models: 9
Best Energy: -7.298 kcal/mol

Binding Energies:
  • Pose 1: -7.298 kcal/mol
  • Pose 2: -7.21 kcal/mol
  • Pose 3: -7.165 kcal/mol
  • Pose 4: -7.144 kcal/mol
  • Pose 5: -7.115 kcal/mol
  • Pose 6: -6.995 kcal/mol
  • Pose 7: -6.945 kcal/mol
  • Pose 8: -6.928 kcal/mol
  • Pose 9: -6.911 kcal/mol
ligand_99_insr
Energy Plot
RMSD Scatter Plot