Re: [ccp4bb] New BUILT of XDS for academic users

2016-12-10 Thread Wei Wang
Dear Kay, I updated this version and noticed some error message that I haven't experience before. When I cp latest geometry description over previous one and rerun integrate & correct, there's a very large chance to get "!!! ERROR !!! CANNOT OPEN OR WRITE SCRATCH FILE IN "STRONGHKL1"". xds_par the

Re: [ccp4bb] XDS questions

2016-11-21 Thread Wei Wang
; > > in XDS (CORRECT) and be done with it. If you want to use Aimless for > > > merging, you can turn off scaling with the ONLYMERGE keyword or use > SCALES > > > CONSTANT. > > > > > > All best. > > > > > > > > > And

Re: [ccp4bb] XDS questions

2016-11-17 Thread Wei Wang
gt; > Dear Wei, > > if you process your data with XDS, the best is probably to do the scaling > in XDS (CORRECT) and be done with it. If you want to use Aimless for > merging, you can turn off scaling with the ONLYMERGE keyword or use SCALES > CONSTANT. > > All best. >

[ccp4bb] XDS questions

2016-11-17 Thread Wei Wang
Hi, Is there a way to let xds_par use less than all processors/threads on the machine? Sometimes I would like to process something else while XDS is running. Another question is related to the scaling procedure. My understanding is that the XDS already does the scaling during correction. So if I