Abstract

A set of components (CMLReact) for managing chemical and biochemical reactions has been added to CML. These can be combined to support most of the strategies for the formal representation of reactions. The elements, attributes, and types are formally defined as XMLSchema components, and their semantics are developed. New syntax and semantics in CML are reported and illustrated with 10 examples.

Keywords

Computer scienceRuleMLXMLSemantics (computer science)Programming languageSyntaxMarkup languageXHTMLSet (abstract data type)Information retrievalWorld Wide WebNatural language processing

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Publication Info

Year
2005
Type
article
Volume
46
Issue
1
Pages
145-157
Citations
66
Access
Closed

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Gemma L. Holliday, Peter Murray‐Rust, Henry S. Rzepa (2005). Chemical Markup, XML, and the World Wide Web. 6. CMLReact, an XML Vocabulary for Chemical Reactions. Journal of Chemical Information and Modeling , 46 (1) , 145-157. https://doi.org/10.1021/ci0502698

Identifiers

DOI
10.1021/ci0502698