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

Docking Result

CHEMBL2058975_dpp4

Atoms: 279
Models: 9
Best Energy: -8.098 kcal/mol

Binding Energies:
  • Pose 1: -8.098 kcal/mol
  • Pose 2: -8.089 kcal/mol
  • Pose 3: -8.022 kcal/mol
  • Pose 4: -7.893 kcal/mol
  • Pose 5: -7.723 kcal/mol
  • Pose 6: -7.705 kcal/mol
  • Pose 7: -7.58 kcal/mol
  • Pose 8: -7.486 kcal/mol
  • Pose 9: -7.473 kcal/mol
CHEMBL2058975_dpp4
Energy Plot
RMSD Scatter Plot