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

Docking Result

CHEMBL4764779_dpp4

Atoms: 378
Models: 9
Best Energy: -8.213 kcal/mol

Binding Energies:
  • Pose 1: -8.213 kcal/mol
  • Pose 2: -7.737 kcal/mol
  • Pose 3: -7.533 kcal/mol
  • Pose 4: -7.529 kcal/mol
  • Pose 5: -7.454 kcal/mol
  • Pose 6: -7.414 kcal/mol
  • Pose 7: -7.346 kcal/mol
  • Pose 8: -7.246 kcal/mol
  • Pose 9: -7.165 kcal/mol
CHEMBL4764779_dpp4
Energy Plot
RMSD Scatter Plot