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

Docking Result

CHEMBL479538_dpp4

Atoms: 252
Models: 9
Best Energy: -7.739 kcal/mol

Binding Energies:
  • Pose 1: -7.739 kcal/mol
  • Pose 2: -7.64 kcal/mol
  • Pose 3: -7.598 kcal/mol
  • Pose 4: -7.441 kcal/mol
  • Pose 5: -7.381 kcal/mol
  • Pose 6: -7.288 kcal/mol
  • Pose 7: -7.199 kcal/mol
  • Pose 8: -7.107 kcal/mol
  • Pose 9: -7.083 kcal/mol
CHEMBL479538_dpp4
Energy Plot
RMSD Scatter Plot