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

Docking Result

CHEMBL2069856_dpp4

Atoms: 306
Models: 9
Best Energy: -8.711 kcal/mol

Binding Energies:
  • Pose 1: -8.711 kcal/mol
  • Pose 2: -8.673 kcal/mol
  • Pose 3: -8.547 kcal/mol
  • Pose 4: -8.513 kcal/mol
  • Pose 5: -8.475 kcal/mol
  • Pose 6: -8.456 kcal/mol
  • Pose 7: -8.411 kcal/mol
  • Pose 8: -8.077 kcal/mol
  • Pose 9: -7.984 kcal/mol
CHEMBL2069856_dpp4
Energy Plot
RMSD Scatter Plot