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

Docking Result

CHEMBL4242883_dpp4

Atoms: 306
Models: 9
Best Energy: -8.353 kcal/mol

Binding Energies:
  • Pose 1: -8.353 kcal/mol
  • Pose 2: -8.315 kcal/mol
  • Pose 3: -7.93 kcal/mol
  • Pose 4: -7.868 kcal/mol
  • Pose 5: -7.779 kcal/mol
  • Pose 6: -7.532 kcal/mol
  • Pose 7: -7.316 kcal/mol
  • Pose 8: -7.223 kcal/mol
  • Pose 9: -7.103 kcal/mol
CHEMBL4242883_dpp4
Energy Plot
RMSD Scatter Plot