%0 Journal Article %1 Murray-Rust1999 %A Murray-Rust, Peter %A Rzepa, Henry S. %B Journal of Chemical Information and Computer Sciences %C Virtual School of Molecular Sciences, School of Pharmaceutical Sciences, University of Nottingham, U.K., and Department of Chemistry, Imperial College of Science, Technology and Medicine, London SW72AY, U.K. %D 1999 %I American Chemical Society %J J. Chem. Inf. Comput. Sci. %K *cul *file-import-13-09-19 cml %N 6 %P 928--942 %R doi:10.1021/ci990052b %T Chemical Markup, XML, and the World Wide Web. 1. Basic Principles %U http://dx.doi.org/doi:10.1021/ci990052b %V 39 %X Chemical markup language (CML) is an application of XML, the extensible markup language, developed for containing chemical information components within documents. Its design supports interoperability with the XML family of tools and protocols. It provides a base functionality for atomic, molecular, and crystallographic information and allows extensibility for other chemical applications. Legacy files can be imported into CML without information loss and can carry any desired chemical ontology. Some applications of CML (Markush structures, chemical searching) will be discussed in later articles. An XML document type declaration (DTD) for CML is included as a Chart.

@article{Murray-Rust1999, abstract = {{Chemical markup language (CML) is an application of XML, the extensible markup language, developed for containing chemical information components within documents. Its design supports interoperability with the XML family of tools and protocols. It provides a base functionality for atomic, molecular, and crystallographic information and allows extensibility for other chemical applications. Legacy files can be imported into CML without information loss and can carry any desired chemical ontology. Some applications of CML (Markush structures, chemical searching) will be discussed in later articles. An XML document type declaration (DTD) for CML is included as a Chart.}}, added-at = {2019-03-11T21:00:05.000+0100}, address = {Virtual School of Molecular Sciences, School of Pharmaceutical Sciences, University of Nottingham, U.K., and Department of Chemistry, Imperial College of Science, Technology and Medicine, London SW72AY, U.K.}, author = {Murray-Rust, Peter and Rzepa, Henry S.}, biburl = {https://www.bibsonomy.org/bibtex/2db18498feb2e4f9a0e8bd031809fdb9a/fairybasslet}, booktitle = {Journal of Chemical Information and Computer Sciences}, citeulike-article-id = {1063869}, citeulike-linkout-0 = {http://dx.doi.org/doi:10.1021/ci990052b}, citeulike-linkout-1 = {http://dx.doi.org/10.1021/ci990052b}, citeulike-linkout-2 = {http://pubs.acs.org/doi/abs/10.1021/ci990052b}, day = 1, doi = {doi:10.1021/ci990052b}, interhash = {527498fcde70a4149d74490df723e574}, intrahash = {db18498feb2e4f9a0e8bd031809fdb9a}, journal = {J. Chem. Inf. Comput. Sci.}, keywords = {*cul *file-import-13-09-19 cml}, month = nov, number = 6, pages = {928--942}, pdf = {file:///H:/publications/Murray-Rust1999.pdf}, posted-at = {2011-11-08 10:17:38}, priority = {3}, publisher = {American Chemical Society}, timestamp = {2019-03-11T21:06:37.000+0100}, title = {{Chemical Markup, XML, and the World Wide Web. 1. Basic Principles}}, url = {http://dx.doi.org/doi:10.1021/ci990052b}, volume = 39, year = 1999 }