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Re: CIF-JSON draft 2017-05-15
- Subject: Re: CIF-JSON draft 2017-05-15
- From: Robert Hanson <hansonr@xxxxxxxxxx>
- Date: Mon, 22 May 2017 05:06:52 -0500
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- In-Reply-To: <D9E3F175030713438B5B5883ABA5812B7515B767@mail03.ccdc.cam.ac.uk>
- References: <CAM+dB2cAAY3CjC741WU0GqaWmAi2iGHtwZ82iA1bCwuNoG6nQg@mail.gmail.com><CAF_YUvVa0JXgAN9Bec6fjd6Nmco5W7EHWLN=Ba=daRR9U-2PzQ@mail.gmail.com><CACaHzQVYeOfS9zTe4gDJMVNCTgxtat0zhMAd2EMX=etXj5g2Gw@mail.gmail.com><CAF_YUvWV3huhwoBuCOkKXqCcYH+8kjFCPjoa=j_v61JC4H32Jg@mail.gmail.com><CAF_YUvUMbVz2j5=XXD5WD3G+0XB4tY=r1zwXuADB14qQNZTPvg@mail.gmail.com><CAF_YUvXPj9g6CEnsKmwZwrp7p550nyykrnQY9iN5wpEnDzrrYQ@mail.gmail.com><CAF_YUvUaJM0bwV4vKZwARQw4Q44LN+TOyr4Ghge3P_qn90tUHQ@mail.gmail.com><CAF_YUvUGexW-7iSfJWQ_c=WZNnbzBJeFaNfzKRVK4DKmdydp+A@mail.gmail.com><CAM+dB2dY8xEp8BeSJfXD5E9+H6-qkBCodMV_gc-fetLNp=x_WA@mail.gmail.com><CAF_YUvU+O3yb-JG_zZWvTW0i7EuzA1_J3c0Q8drWqb6rScSkEw@mail.gmail.com><CAF_YUvWT4ZGT_BbpmB2G3Ya7ttzj70qXD7UofyAsPb010W_XJw@mail.gmail.com><CAF_YUvXb4jbKxSh=Q9Q76Zay-RMi8xXU_geQ5FB76cj5iozkOQ@mail.gmail.com><CAF_YUvW01EL98PYcAq0fADvF9BK6oJTdhe4Ju9byg5x5bmGc2Q@mail.gmail.com><CAM+dB2fz+Y45c+Cgk7BABsSPQB2FKe9JxX2j+fRgPC+ehh-ddw@mail.gmail.com><CAF_YUvWnEq0XsQCUhh3bis=vukuf3BQF=QxGi8HS5rTpc4uvkw@mail.gmail.com><CACaHzQUhG8ndiKBSX3OeB=vkn3pu+DugJ=wCEz8podKstFsQZA@mail.gmail.com><CAF_YUvUhv1Li3b-oLkASzq7SnV734WEozPWnMMcHAbVhOcT_Jg@mail.gmail.com><CACaHzQXm3Lti+cP_mQDFnkPdN1ia=--RmGTnPOOyYqP3doJTZw@mail.gmail.com><CAF_YUvXi_UgN9Fc+MATbP-ROKyG31fjcc4HcoS7UEs+2jh3CYA@mail.gmail.com><CAF_YUvXYCLN8gAjDZndba1UCgsgvRTavHKJR28VqAG2Hh4xSVQ@mail.gmail.com><CAM+dB2cjf2EoR3o6MtLHBqRirBzgPSG5iz+eYEK5qtbiMy5Acw@mail.gmail.com><D9E3F175030713438B5B5883ABA5812B7515B767@mail03.ccdc.cam.ac.uk>
On Mon, May 22, 2017 at 3:29 AM, Matthew Towler <towler@ccdc.cam.ac.uk> wrote:
As the CCDC’s treatment of concatenation appears to be of repeated interest for this thread I felt I should comment. Yes, this is exactly what the CCDC does. In practice only a small number of structures usually appear in one file, and names tend to vary, so the odds of a name collision are really quite lowand I am unaware we have had significant feedback that this is causing any problem for users.
Actually, this is not true. When the files from supplemental material are combined, each has "data_1" in it. At least for this example: https://www.ccdc.cam.ac.uk/structures/search?pid=ccdc:1514731-1514735&issn=1463-9076&year=2017&pages=2900-2907&volume=19&id=doi:10.1039/c6cp07552e&sid=RSC
Maybe this is just a failure in the publication process at RSC to properly compose the CIF files. For in each one we see something like this:
data_1
_audit_block_doi 10.5517/ccdc.csd.cc1mv6f3
_database_code_depnum_ccdc_archive 'CCDC 1514735'
data_1
_audit_block_doi 10.5517/ccdc.csd.cc1mv6f3
_database_code_depnum_ccdc_archive 'CCDC 1514735'
instead of
data_1514735
_audit_block_doi 10.5517/ccdc.csd.cc1mv6f3
_database_code_depnum_ccdc_archive 'CCDC 1514735'
data_1514735
_audit_block_doi 10.5517/ccdc.csd.cc1mv6f3
_database_code_depnum_ccdc_archive 'CCDC 1514735'
Anyway, I suggest thatCIF-JSON needs to have an alternative mechanism to concatenate files, as I have indicated.
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- Re: CIF-JSON draft 2017-05-15 (Marcin Wojdyr)
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- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
- Re: CIF-JSON draft 2017-05-15 (James Hester)
- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
- Re: CIF-JSON draft 2017-05-15 (Robert Hanson)
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