Linked Life Data

19171970

Source:http://linkedlifedata.com/resource/pubmed/id/19171970

Statements in which the resource exists as a subject.
PredicateObject
rdf:type
lifeskim:mentions
pubmed:issue
Pt 2
pubmed:dateCreated
2009-1-27
pubmed:abstractText
Automated structure validation was introduced in chemical crystallography about 12 years ago as a tool to assist practitioners with the exponential growth in crystal structure analyses. Validation has since evolved into an easy-to-use checkCIF/PLATON web-based IUCr service. The result of a crystal structure determination has to be supplied as a CIF-formatted computer-readable file. The checking software tests the data in the CIF for completeness, quality and consistency. In addition, the reported structure is checked for incomplete analysis, errors in the analysis and relevant issues to be verified. A validation report is generated in the form of a list of ALERTS on the issues to be corrected, checked or commented on. Structure validation has largely eliminated obvious problems with structure reports published in IUCr journals, such as refinement in a space group of too low symmetry. This paper reports on the current status of structure validation and possible future extensions.
pubmed:commentsCorrections
http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-10710675, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-11717479, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-12037359, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-12203563, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-15554684, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-16983149, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-17478898, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-18156677, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-18758012, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-19750788, http://linkedlifedata.com/resource/pubmed/commentcorrection/19171970-3271104
pubmed:language
eng
pubmed:journal
pubmed:citationSubset
IM
pubmed:status
MEDLINE
pubmed:month
Feb
pubmed:issn
1399-0047
pubmed:author
pubmed:issnType
Electronic
pubmed:volume
65
pubmed:owner
NLM
pubmed:authorsComplete
Y
pubmed:pagination
148-55
pubmed:dateRevised
2010-9-23
pubmed:meshHeading
pubmed:year
2009
pubmed:articleTitle
Structure validation in chemical crystallography.
pubmed:affiliation
Utrecht University, Bijvoet Center for Biomolecular Research, Utrecht, The Netherlands. a.l.spek@uu.nl
pubmed:publicationType
Journal Article