InChI: open-source chemical structure representation algorithm
Application Audience Cheminformatics Content type Document English ePub File Type Graduate HTML InChI Algorithm and Description InChI Application Language Organic Chemistry PDF Publication Researcher Resolvers Search Software Software Undergraduate

InChI, the IUPAC International Chemical Identifier

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InChI, the IUPAC International Chemical Identifier
Authored by:
Stephen R Heller
Alan McNaught
Igor Pletnev
Stephen Stein
Dmitrii Tchekhovskoi

Abstract

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

Information
Content Type OER
Uploaded By Andrew Cornell
DOI https://doi.org/10.1186/s13321-015-0068-4
Content Link https://jcheminf.biomedcentral.com/track/pdf/10.1186/s13321-015-0068-4
License Open Access
Content Status publish
Number of Comments No Comments
Date Published May 13, 2015
Content Tags Application, Audience, Cheminformatics, Content type, Document, English, File Type, Graduate, HTML, InChI Algorithm and Description, InChI Application, Language, Organic Chemistry, PDF, Publication, Researcher, Resolvers, Search, Software, Undergraduate, ePub

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