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

Docking Result

CHEMBL1683112_dpp4

Atoms: 270
Models: 9
Best Energy: -7.258 kcal/mol

Binding Energies:
  • Pose 1: -7.258 kcal/mol
  • Pose 2: -7.128 kcal/mol
  • Pose 3: -7.078 kcal/mol
  • Pose 4: -6.992 kcal/mol
  • Pose 5: -6.92 kcal/mol
  • Pose 6: -6.809 kcal/mol
  • Pose 7: -6.776 kcal/mol
  • Pose 8: -6.759 kcal/mol
  • Pose 9: -6.661 kcal/mol
CHEMBL1683112_dpp4
Energy Plot
RMSD Scatter Plot