Document Detail


Chemical Markup, XML, and the World Wide Web. 7. CMLSpect, an XML vocabulary for spectral data.
MedLine Citation:
PMID:  17887743     Owner:  NLM     Status:  MEDLINE    
Abstract/OtherAbstract:
CMLSpect is an extension of Chemical Markup Language (CML) for managing spectral and other analytical data. It is designed to be flexible enough to contain a wide variety of spectral data. The paper describes the CMLElements used and gives practical examples for common types of spectra. In addition it demonstrates how different views of the data can be expressed and what problems still exist.
Authors:
Stefan Kuhn; Tobias Helmus; Robert J Lancashire; Peter Murray-Rust; Henry S Rzepa; Christoph Steinbeck; Egon L Willighagen
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Publication Detail:
Type:  Journal Article; Research Support, Non-U.S. Gov't     Date:  2007-09-22
Journal Detail:
Title:  Journal of chemical information and modeling     Volume:  47     ISSN:  1549-9596     ISO Abbreviation:  -     Publication Date:    2007 Nov-Dec
Date Detail:
Created Date:  2007-11-26     Completed Date:  2008-02-15     Revised Date:  -    
Medline Journal Info:
Nlm Unique ID:  101230060     Medline TA:  J Chem Inf Model     Country:  United States    
Other Details:
Languages:  eng     Pagination:  2015-34     Citation Subset:  IM    
Affiliation:
Cologne University Bioinformatics Center (CUBIC), Cologne, Germany.
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MeSH Terms
Descriptor/Qualifier:
Internet*
Microscopy
Molecular Structure
Spectrum Analysis

From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine


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