InChI, the IUPAC International Chemical Identifier

This paper documents the design, layout and algorithms of the IUPAC International Chemical Identifier, InChI.

Detalles Bibliográficos
Autores principales: Heller, Stephen R, McNaught, Alan, Pletnev, Igor, Stein, Stephen, Tchekhovskoi, Dmitrii
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2015
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4486400/
https://www.ncbi.nlm.nih.gov/pubmed/26136848
http://dx.doi.org/10.1186/s13321-015-0068-4
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author Heller, Stephen R
McNaught, Alan
Pletnev, Igor
Stein, Stephen
Tchekhovskoi, Dmitrii
author_facet Heller, Stephen R
McNaught, Alan
Pletnev, Igor
Stein, Stephen
Tchekhovskoi, Dmitrii
author_sort Heller, Stephen R
collection PubMed
description This paper documents the design, layout and algorithms of the IUPAC International Chemical Identifier, InChI.
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spelling pubmed-44864002015-07-02 InChI, the IUPAC International Chemical Identifier Heller, Stephen R McNaught, Alan Pletnev, Igor Stein, Stephen Tchekhovskoi, Dmitrii J Cheminform Research Article This paper documents the design, layout and algorithms of the IUPAC International Chemical Identifier, InChI. Springer International Publishing 2015-05-30 /pmc/articles/PMC4486400/ /pubmed/26136848 http://dx.doi.org/10.1186/s13321-015-0068-4 Text en © Heller et al. 2015 This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0), which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly credited. The Creative Commons Public Domain Dedication waiver (http://creativecommons.org/publicdomain/zero/1.0/) applies to the data made available in this article, unless otherwise stated.
spellingShingle Research Article
Heller, Stephen R
McNaught, Alan
Pletnev, Igor
Stein, Stephen
Tchekhovskoi, Dmitrii
InChI, the IUPAC International Chemical Identifier
title InChI, the IUPAC International Chemical Identifier
title_full InChI, the IUPAC International Chemical Identifier
title_fullStr InChI, the IUPAC International Chemical Identifier
title_full_unstemmed InChI, the IUPAC International Chemical Identifier
title_short InChI, the IUPAC International Chemical Identifier
title_sort inchi, the iupac international chemical identifier
topic Research Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4486400/
https://www.ncbi.nlm.nih.gov/pubmed/26136848
http://dx.doi.org/10.1186/s13321-015-0068-4
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AT pletnevigor inchitheiupacinternationalchemicalidentifier
AT steinstephen inchitheiupacinternationalchemicalidentifier
AT tchekhovskoidmitrii inchitheiupacinternationalchemicalidentifier

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