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

Docking Result

ligand_249_insr

Atoms: 414
Models: 9
Best Energy: -12.36 kcal/mol

Binding Energies:
  • Pose 1: -12.36 kcal/mol
  • Pose 2: -11.6 kcal/mol
  • Pose 3: -11.541 kcal/mol
  • Pose 4: -11.326 kcal/mol
  • Pose 5: -11.25 kcal/mol
  • Pose 6: -10.676 kcal/mol
  • Pose 7: -10.264 kcal/mol
  • Pose 8: -9.955 kcal/mol
  • Pose 9: -9.92 kcal/mol
ligand_249_insr
Energy Plot
RMSD Scatter Plot