next up previous contents index
Next: automodel.auto_align() generate Up: automodel reference Previous: automodel.get_refine_actions() get   Contents   Index

automodel.select_atoms() -- select region for optimization

select_atoms()
By default, this selects all atoms in the system. Only the selected atoms are optimized in model building, so you can redefine this routine to select the region of interest, if so desired. See section 2.2.6 for an example.



Automatic builds 2011-03-29