Hi Engin,
I encountered the same issue a couple of months ago. As I understand,
the REMOVE.HKL file will only be used if you specify the spacegroup
and unit cell in the XDS.INP file.
Cheers,
Florian
On Jul 25, 2011, at 1:14 PM, Engin Özkan wrote:
> Hi all,
>
> After about a year of not working with XDS, I was a little surprised
> to see that adding a REMOVE.HKL file to the current directory and
> running CORRECT does not remove outliers. I still see the same
> reflections reported at the end of my new CORRECT.LP file and I have
> grepped the XDS_ASCII.HKL file to observe, to my dismay, that the
> "removed" are still present. Since I do not see this reported and
> this must be a daily used option by many of you out there, I am
> guessing that I must be doing something wrong, but it escapes me.
>
> For my and anybody else's sanity, here is my REMOVE.HKL file:
> $ more REMOVE.HKL
> 21 15 -17 2.10 963.70 0.1638E+06 0.9804E+04 "alien"
> 3 9 -27 2.17 58.11 0.2972E+04 0.1788E+03 "alien"
> 3 11 -26 2.17 32.12 0.1643E+04 0.1002E+03 "alien"
> 25 9 -20 2.04 11.89 0.3647E+03 0.1498E+02 "alien"
> 2 4 -33 1.87 10.88 0.1215E+03 0.8789E+01 "alien"
> 13 9 -19 2.71 10.69 0.1397E+04 0.4445E+02 "alien"
> 17 7 -29 1.99 10.65 0.2353E+03 0.1573E+02 "alien"
> 16 14 -29 1.83 10.58 0.8817E+02 0.9706E+01 "alien"
> 18 12 -28 1.90 10.16 0.1566E+03 0.1325E+02 "alien"
>
> I am using the most recently updated version of xds on a Scientific
> Linux 6.0 (64-bit) machine.
>
> Hey, I just figured out that using the December 6, 2010 version
> installed back in January on a different 64-bit linux machine, the
> REMOVE.HKL file was successfully used. So this may be a problem with
> the recent bug-fix update (which we have through SBGrid).
>
> All clues, hits, pointers are appreciated.
>
> Best,
>
> Engin
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