Well - it certainly SHOULDnt happen! But there seems to be a bug in CAD
I am having trouble testing it but will keep on trying..
Eleanor
wtempel wrote:
> Dear colleagues,
> trying to be a responsible citizen, I occasionally activate the "Copy
> Rfree from another MTZ" button in the {Data Reduction|Import
> Integrated Data|Import Merged Data} CCP4I task. This appears to have
> the unintended effect of setting the "relevant/dataset" (as opposed to
> the "obsolete") cell constants to the value provided by the RFREE
> file, not the scalepack file to be imported, even though the scalepack
> cell constants are shown in the task window.
> I should clarify that this use case arises for me when switching (for
> numerous reasons) from one diffraction data set to another, both data
> sets being approximately, but not precisely, isomorphous.
> Is the behavior of cell constant settings I described intended this
> way? Am I abusing this specific CCP4I task?
> I appreciate your comments and wish everyone Happy Holidays.
> Wolfram Tempel
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