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

Docking Result

CHEMBL218393_dpp4

Atoms: 270
Models: 9
Best Energy: -8.047 kcal/mol

Binding Energies:
  • Pose 1: -8.047 kcal/mol
  • Pose 2: -7.773 kcal/mol
  • Pose 3: -7.708 kcal/mol
  • Pose 4: -7.563 kcal/mol
  • Pose 5: -7.492 kcal/mol
  • Pose 6: -7.475 kcal/mol
  • Pose 7: -7.386 kcal/mol
  • Pose 8: -7.385 kcal/mol
  • Pose 9: -7.368 kcal/mol
CHEMBL218393_dpp4
Energy Plot
RMSD Scatter Plot