articleJournal of Applied CrystallographyJan 21, 2003BRONZE OA

Single-crystal structure validation with the program PLATON

Utrecht University

Indexed incrossref

Abstract

The results of a single-crystal structure determination when in CIF format can now be validated routinely by automatic procedures. In this way, many errors in published papers can be avoided. The validation software generates a set of ALERTS detailing issues to be addressed by the experimenter, author, referee and publication journal. Validation was pioneered by the IUCr journal Acta Crystallographica Section C and is currently standard procedure for structures submitted for publication in all IUCr journals. The implementation of validation procedures by other journals is in progress. This paper describes the concepts of validation and the classes of checks that are carried out by the program PLATON as part of…

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Topics & keywords

Keywords
  • Computer science
  • Section (typography)
  • Set (abstract data type)
  • Programming language
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