Table 1.
Category | Flexibility | Description | Examples |
---|---|---|---|
Template docking | None or little | Use sequence-based homology model to predict docking poses | GalaxyPepDock |
Ensemble docking | Conformation ensemble | Prepare a conformation ensemble to describe peptide flexibility and then dock the conformations back into receptor |
|
De novo method | Fully flexible | Model peptide flexibility with the respect to the receptor |
ADCP
|