[phenixbb] advice for refinement with anomalous information
nechols at lbl.gov
Fri Aug 27 11:14:41 PDT 2010
On Thu, Aug 26, 2010 at 9:46 PM, Ralf W. Grosse-Kunstleve
<rwgk at cci.lbl.gov> wrote:
> The selection field in the GUI is also a general atom selection string.
> I.e. in your case you need to enter
> name CD
> In other cases you may want to enter things like
> chain A and resname LIG and name CD
> See the section on atom selections in the phenix.refine documentation.
One additional note: if you're using the GUI, click the "view/pick"
button next to the atom selection field and it will display exactly
which atoms are selected - or an error if you used the wrong syntax.
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