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

Docking Result

CHEMBL1614845_dpp4

Atoms: 387
Models: 9
Best Energy: -8.465 kcal/mol

Binding Energies:
  • Pose 1: -8.465 kcal/mol
  • Pose 2: -8.269 kcal/mol
  • Pose 3: -8.202 kcal/mol
  • Pose 4: -8.015 kcal/mol
  • Pose 5: -7.782 kcal/mol
  • Pose 6: -7.731 kcal/mol
  • Pose 7: -7.644 kcal/mol
  • Pose 8: -7.629 kcal/mol
  • Pose 9: -7.581 kcal/mol
CHEMBL1614845_dpp4
Energy Plot
RMSD Scatter Plot