[phenixbb] anomalous scatters refinement
pafonine at lbl.gov
Tue Dec 2 10:48:14 PST 2008
I'm not sure that there is a universal answer to this. I would just try
and see if the result makes sense. In phenix.refine you can do it by
adding "group_anomalous" to "strategy" and specifying what are the
anomalous scatterers to be refined (use "anomalous_scatterers" scope of
parameters for this). See "f' and f'' refinement" section of
phenix.refine documentation for details:
Please let me know if you have any questions.
On 12/2/2008 10:23 AM, Daniele de Sanctis wrote:
> I'm making some refinement tests with anomalous data and I wanted to
> try to refine the anomalous contribution. When would it be the best
> stage when to introduce it?
More information about the phenixbb