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

Docking Result

ligand_16_insr

Atoms: 189
Models: 9
Best Energy: -8.425 kcal/mol

Binding Energies:
  • Pose 1: -8.425 kcal/mol
  • Pose 2: -8.412 kcal/mol
  • Pose 3: -8.226 kcal/mol
  • Pose 4: -8.183 kcal/mol
  • Pose 5: -8.116 kcal/mol
  • Pose 6: -8.058 kcal/mol
  • Pose 7: -8.031 kcal/mol
  • Pose 8: -7.842 kcal/mol
  • Pose 9: -7.808 kcal/mol
ligand_16_insr
Energy Plot
RMSD Scatter Plot