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

Docking Result

CHEMBL493760_dpp4

Atoms: 216
Models: 9
Best Energy: -7.915 kcal/mol

Binding Energies:
  • Pose 1: -7.915 kcal/mol
  • Pose 2: -7.907 kcal/mol
  • Pose 3: -7.675 kcal/mol
  • Pose 4: -7.371 kcal/mol
  • Pose 5: -7.292 kcal/mol
  • Pose 6: -7.255 kcal/mol
  • Pose 7: -7.164 kcal/mol
  • Pose 8: -7.132 kcal/mol
  • Pose 9: -7.075 kcal/mol
CHEMBL493760_dpp4
Energy Plot
RMSD Scatter Plot