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

Docking Result

ligand_45_insr

Atoms: 270
Models: 9
Best Energy: -10.046 kcal/mol

Binding Energies:
  • Pose 1: -10.046 kcal/mol
  • Pose 2: -9.498 kcal/mol
  • Pose 3: -9.244 kcal/mol
  • Pose 4: -9.217 kcal/mol
  • Pose 5: -9.145 kcal/mol
  • Pose 6: -9.051 kcal/mol
  • Pose 7: -8.825 kcal/mol
  • Pose 8: -8.688 kcal/mol
  • Pose 9: -8.613 kcal/mol
ligand_45_insr
Energy Plot
RMSD Scatter Plot