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

Docking Result

ligand_12_insr

Atoms: 324
Models: 9
Best Energy: -10.502 kcal/mol

Binding Energies:
  • Pose 1: -10.502 kcal/mol
  • Pose 2: -10.457 kcal/mol
  • Pose 3: -10.302 kcal/mol
  • Pose 4: -10.086 kcal/mol
  • Pose 5: -9.888 kcal/mol
  • Pose 6: -9.84 kcal/mol
  • Pose 7: -9.835 kcal/mol
  • Pose 8: -9.761 kcal/mol
  • Pose 9: -9.492 kcal/mol
ligand_12_insr
Energy Plot
RMSD Scatter Plot