Mercurial > repos > recetox > riassigner
diff macros.xml @ 3:113f5f66e6b9 draft
"planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/riassigner commit 9bc547872c98a9c13c561d15e8990fe82bdc0e72"
author | recetox |
---|---|
date | Fri, 28 Jan 2022 16:30:37 +0000 |
parents | 3c396ae0a1e7 |
children | 97c020d36c8f |
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--- a/macros.xml Tue Jan 25 09:39:36 2022 +0000 +++ b/macros.xml Fri Jan 28 16:30:37 2022 +0000 @@ -2,14 +2,24 @@ <token name="@TOOL_VERSION@">0.3.1</token> <xml name="creator"> <creator> + <person + givenName="Helge" + familyName="Hecht" + url="https://github.com/hechth" + identifier="0000-0001-6744-996X" /> <organization url="https://www.recetox.muni.cz/" + email="GalaxyToolsDevelopmentandDeployment@space.muni.cz" name="RECETOX MUNI" /> </creator> </xml> + <token name="@HELP@"> <![CDATA[ - RIAssigner can be used to read data from .msp, .csv and .tsv files using matchms and pandas and to compute the retention indices for the data. A reference list of retention indexed compounds (traditionally an Alkane series) with retention times is used to compute the RI for a query dataset of retention time values using the van den Dool method or by using cubic spline based interpolation. + RIAssigner can be used to read data from .msp, .csv and .tsv files using matchms and pandas and to compute the + retention indices for the data. A reference list of retention indexed compounds (traditionally an Alkane series) + with retention times is used to compute the RI for a query dataset of retention time values using the van den + Dool method or by using cubic spline based interpolation. ]]> </token> </macros>