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

Docking Result

ligand_5_insr

Atoms: 216
Models: 9
Best Energy: -7.622 kcal/mol

Binding Energies:
  • Pose 1: -7.622 kcal/mol
  • Pose 2: -7.556 kcal/mol
  • Pose 3: -7.343 kcal/mol
  • Pose 4: -7.205 kcal/mol
  • Pose 5: -7.201 kcal/mol
  • Pose 6: -7.137 kcal/mol
  • Pose 7: -7.111 kcal/mol
  • Pose 8: -7.106 kcal/mol
  • Pose 9: -7.019 kcal/mol
ligand_5_insr
Energy Plot
RMSD Scatter Plot