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

Docking Result

ligand_81_insr

Atoms: 342
Models: 9
Best Energy: -10.321 kcal/mol

Binding Energies:
  • Pose 1: -10.321 kcal/mol
  • Pose 2: -9.928 kcal/mol
  • Pose 3: -9.568 kcal/mol
  • Pose 4: -9.398 kcal/mol
  • Pose 5: -9.345 kcal/mol
  • Pose 6: -9.3 kcal/mol
  • Pose 7: -9.079 kcal/mol
  • Pose 8: -8.198 kcal/mol
  • Pose 9: -8.103 kcal/mol
ligand_81_insr
Energy Plot
RMSD Scatter Plot