[phenixbb] sca file & anomalous difference map: understanding the story from the scratch,

Ralf Grosse-Kunstleve rwgrosse-kunstleve at lbl.gov
Mon Jun 13 10:16:01 PDT 2011


Hi Nat,


> Unfortunately Phenix does not always treat labels the same between
> different reflection file formats.  In MTZ files there is a strict
> correspondence between "column labels" and what you see in the various
> programs in Phenix, so anomalous intensities with sigmas will always appear
> as something like "I(+),SIGI(+),I(-),SIGI(-)".  Scalepack files will always
> appear as "i_obs,sigma" whether or not they contain anomalous data.
>

This is really easy to change. What labels would be best?
"i_obs,sigma(+/-)"
?

Ralf
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