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

Docking Result

CHEMBL567278_dpp4

Atoms: 270
Models: 9
Best Energy: -8.268 kcal/mol

Binding Energies:
  • Pose 1: -8.268 kcal/mol
  • Pose 2: -8.015 kcal/mol
  • Pose 3: -7.911 kcal/mol
  • Pose 4: -7.758 kcal/mol
  • Pose 5: -7.566 kcal/mol
  • Pose 6: -7.564 kcal/mol
  • Pose 7: -7.558 kcal/mol
  • Pose 8: -7.542 kcal/mol
  • Pose 9: -7.445 kcal/mol
CHEMBL567278_dpp4
Energy Plot
RMSD Scatter Plot