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

Docking Result

CHEMBL36333_dpp4

Atoms: 234
Models: 9
Best Energy: -7.981 kcal/mol

Binding Energies:
  • Pose 1: -7.981 kcal/mol
  • Pose 2: -7.438 kcal/mol
  • Pose 3: -7.301 kcal/mol
  • Pose 4: -7.169 kcal/mol
  • Pose 5: -7.106 kcal/mol
  • Pose 6: -7.1 kcal/mol
  • Pose 7: -7.098 kcal/mol
  • Pose 8: -7.051 kcal/mol
  • Pose 9: -6.971 kcal/mol
CHEMBL36333_dpp4
Energy Plot
RMSD Scatter Plot