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

Docking Result

CHEMBL359759_dpp4

Atoms: 288
Models: 9
Best Energy: -8.052 kcal/mol

Binding Energies:
  • Pose 1: -8.052 kcal/mol
  • Pose 2: -7.9 kcal/mol
  • Pose 3: -7.697 kcal/mol
  • Pose 4: -7.669 kcal/mol
  • Pose 5: -7.652 kcal/mol
  • Pose 6: -7.635 kcal/mol
  • Pose 7: -7.51 kcal/mol
  • Pose 8: -7.509 kcal/mol
  • Pose 9: -7.334 kcal/mol
CHEMBL359759_dpp4
Energy Plot
RMSD Scatter Plot