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

Docking Result

CHEMBL244010_dpp4

Atoms: 234
Models: 9
Best Energy: -7.853 kcal/mol

Binding Energies:
  • Pose 1: -7.853 kcal/mol
  • Pose 2: -7.755 kcal/mol
  • Pose 3: -7.653 kcal/mol
  • Pose 4: -7.563 kcal/mol
  • Pose 5: -7.557 kcal/mol
  • Pose 6: -7.52 kcal/mol
  • Pose 7: -7.439 kcal/mol
  • Pose 8: -7.157 kcal/mol
  • Pose 9: -7.154 kcal/mol
CHEMBL244010_dpp4
Energy Plot
RMSD Scatter Plot