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

Docking Result

CHEMBL3929627_dpp4

Atoms: 351
Models: 9
Best Energy: -7.548 kcal/mol

Binding Energies:
  • Pose 1: -7.548 kcal/mol
  • Pose 2: -7.366 kcal/mol
  • Pose 3: -7.29 kcal/mol
  • Pose 4: -7.121 kcal/mol
  • Pose 5: -7.102 kcal/mol
  • Pose 6: -7.028 kcal/mol
  • Pose 7: -6.998 kcal/mol
  • Pose 8: -6.942 kcal/mol
  • Pose 9: -6.93 kcal/mol
CHEMBL3929627_dpp4
Energy Plot
RMSD Scatter Plot