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Re: [Imgcif-l] CBF file templates
- To: <imgcif-l@iucr.org>
- Subject: Re: [Imgcif-l] CBF file templates
- From: <Graeme.Winter@Diamond.ac.uk>
- Date: Thu, 1 Oct 2009 08:55:40 +0100
- In-Reply-To: <267DD4BDD5857E47B57FE9EC006D051075C8DB@ADSCDC1.adsc.local>
- References: <4854F2500EA8C4478A508D2D92973E52047BE339@EXCHANGE25.fed.cclrc.ac.uk><20090929061322.N74653@epsilon.pair.com><4854F2500EA8C4478A508D2D92973E52047BE33D@EXCHANGE25.fed.cclrc.ac.uk><alpine.DEB.1.10.0909301010360.31750@agni.phys.iit.edu><267DD4BDD5857E47B57FE9EC006D051075C8DB@ADSCDC1.adsc.local>
Hi Chris, Here's my thoughts so far: we prepare a template on a per-run basis (i.e. for the measurement of each sweep) from some kind of central template, which will contain everything but the contents of e.g. the current ADSC header. Then the detector control software populates what it knows - therefore, if there are ? left in the header it's our fault as the detector control software is only doing what it does already. No code yet - been figuring out the CIF for the additional records we want to store, and the mechanisms to put in place to make this happen. Working from the starting point of ? = replace me, moving forward should be fine. Does the ADSC software allow for a template? If so, how should we do this? Thanks, Graeme Ps... "but I would suggest that if the DLS beamlines do a good job of it" - that's the plan :o) -----Original Message----- From: imgcif-l-bounces@iucr.org [mailto:imgcif-l-bounces@iucr.org] On Behalf Of Chris Nielsen Sent: 30 September 2009 23:33 To: The Crystallographic Binary File and its imgCIF application to image data; The Crystallographic Binary File and its imgCIF application to image data Subject: Re: [Imgcif-l] CBF file templates Hi All, I tend to agree that a complete filling-in of the nominal template is probably not going happen in many places, at least to start, but I would suggest that if the DLS beamlines do a good job of it and the "extra" (beyond essential data processing header items) turn out to be useful for this or that, more beam lines will do a more complete job. I'd note that these items should be sort of "backward compatible" in the sense that, to start with, if you only fill in a few "extra" items it should not matter that a future header has more complete information. It's hard to see the downside in this. Graeme: What are your thoughts on the coding required to do this? Have you made an attempt yet? Chris ________________________________ From: imgcif-l-bounces@iucr.org on behalf of Andy Howard Sent: Wed 9/30/2009 8:13 AM To: The Crystallographic Binary File and its imgCIF application to image data Subject: Re: [Imgcif-l] CBF file templates Hi folks, > One template per beamline is probably, in reality, the way it would > work. We would just make sure that they are all the same. Adding ???? > For the detector software to fill in sounds like good sense. Is this > kind of thing supported? An alternative is to have some boiler plate > which needs to be copied in, then work on getting the format for the > detector produced bit the same. These are essentially the same problem. > > What's the consensus on the best approach? Does everyone support the > use of templates? > ... I support templating, but compliance is likely to be an issue. When Jim Pflugrath deliberately put in-your-face comments into the D*Trek "comments" header slots that were designed to force beamlines to customize their local implementations, seveal of the beamlines that used D*Trek ignored those comments. So a lot of D*Trek-aquired data have comments fields that contain language like "This is a meaningless header that should be replaced by something with content". _____________________________________________________________ / Andrew J.Howard, Associate Professor of Biology and Physics \ | CSRRI, Biological, Chemical, & Physical Sciences Department | College | of Science&Letters, Illinois Institute of Technology| | 3101 South Dearborn Street, Chicago Illinois 60616 USA | | Co-director, IIT Masters in Health Physics program | | phone: 312-567-5881; fax: 312-567-3576; cell 773-368-5067 | | e-mail: howard@iit.edu; web: http://csrri.iit.edu/~howard/ | \____________________________________________________________/ _______________________________________________ imgcif-l mailing list imgcif-l@iucr.org http://scripts.iucr.org/mailman/listinfo/imgcif-l _______________________________________________ imgcif-l mailing list imgcif-l@iucr.org http://scripts.iucr.org/mailman/listinfo/imgcif-l This e-mail and any attachments may contain confidential, copyright and or privileged material, and are for the use of the intended addressee only. 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- References:
- [Imgcif-l] CBF file templates (Winter, Graeme (DLSLtd,RAL,DIA))
- Re: [Imgcif-l] CBF file templates (Herbert J. Bernstein)
- Re: [Imgcif-l] CBF file templates (Winter, Graeme (DLSLtd,RAL,DIA))
- Re: [Imgcif-l] CBF file templates (Andy Howard)
- Re: [Imgcif-l] CBF file templates (Chris Nielsen)
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