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

Docking Result

CHEMBL482262_dpp4

Atoms: 261
Models: 9
Best Energy: -8.287 kcal/mol

Binding Energies:
  • Pose 1: -8.287 kcal/mol
  • Pose 2: -7.806 kcal/mol
  • Pose 3: -7.781 kcal/mol
  • Pose 4: -7.56 kcal/mol
  • Pose 5: -7.54 kcal/mol
  • Pose 6: -7.509 kcal/mol
  • Pose 7: -7.268 kcal/mol
  • Pose 8: -7.188 kcal/mol
  • Pose 9: -7.07 kcal/mol
CHEMBL482262_dpp4
Energy Plot
RMSD Scatter Plot