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

Docking Result

ligand_20_insr

Atoms: 387
Models: 9
Best Energy: -10.768 kcal/mol

Binding Energies:
  • Pose 1: -10.768 kcal/mol
  • Pose 2: -10.63 kcal/mol
  • Pose 3: -10.223 kcal/mol
  • Pose 4: -9.673 kcal/mol
  • Pose 5: -9.548 kcal/mol
  • Pose 6: -9.29 kcal/mol
  • Pose 7: -9.103 kcal/mol
  • Pose 8: -9.038 kcal/mol
  • Pose 9: -9.007 kcal/mol
ligand_20_insr
Energy Plot
RMSD Scatter Plot