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

Docking Result

CHEMBL3329633_dpp4

Atoms: 261
Models: 9
Best Energy: -7.803 kcal/mol

Binding Energies:
  • Pose 1: -7.803 kcal/mol
  • Pose 2: -7.634 kcal/mol
  • Pose 3: -7.593 kcal/mol
  • Pose 4: -7.514 kcal/mol
  • Pose 5: -7.415 kcal/mol
  • Pose 6: -7.167 kcal/mol
  • Pose 7: -7.132 kcal/mol
  • Pose 8: -7.111 kcal/mol
  • Pose 9: -7.054 kcal/mol
CHEMBL3329633_dpp4
Energy Plot
RMSD Scatter Plot