InChI: open-source chemical structure representation algorithm
Audience Content type English Excel File Type Graduate Language Researcher Spreadsheet Undergraduate

Identifier conversion on an Excel spreadsheet

by |Published

Identifier conversion on an Excel spreadsheet

This resource is a simple spreadsheet in Excel that provides a handy interconversion between different chemical identifiers, namely name, InChI, InChIKey and SMILES. It uses some web services to do translations, i.e. PubChem PUG REST and NCI/CADD Chemical Identifier Resolver.

This workbook does not uses macros but makes use of the WEBSERVICE function added to Excel for Windows in Excel 2013.

 

Information
Content Type OER
Uploaded By Jordi Cuadros
Download Publication Files https://www.inchi-trust.org/wp/wp-content/uploads/2018/07/ExcelResolver.xlsx
License CC-BY
Content Status publish
Number of Comments No Comments
Date Published
Content Tags Audience, Content type, English, Excel, File Type, Graduate, Language, Researcher, Spreadsheet, Undergraduate

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