Mercurial > repos > recetox > riassigner
changeset 3:8c5e65adf694 draft
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/riassigner commit b1cc1aebf796f170d93e3dd46ffcdefdc7b8018a
author | recetox |
---|---|
date | Thu, 12 Oct 2023 13:31:32 +0000 |
parents | 4e47a0fa9287 |
children | 79818ce5a8bf |
files | riassigner.xml test-data/Alkanes_20210325.csv test-data/aplcms_aligned_peaks.csv test-data/results.csv |
diffstat | 4 files changed, 7724 insertions(+), 1 deletions(-) [+] |
line wrap: on
line diff
--- a/riassigner.xml Thu Jun 22 15:19:27 2023 +0000 +++ b/riassigner.xml Thu Oct 12 13:31:32 2023 +0000 @@ -1,4 +1,4 @@ -<tool id="riassigner" name="RIAssigner" version="@TOOL_VERSION@+galaxy2" profile="21.09"> +<tool id="riassigner" name="RIAssigner" version="@TOOL_VERSION@+galaxy4" profile="21.09"> <description>compute retention indices</description> <macros> <import>macros.xml</import> @@ -75,4 +75,8 @@ @HELP@ ]]> </help> + + <citations> + <citation type="doi">10.21105/joss.04337</citation> + </citations> </tool>
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/test-data/Alkanes_20210325.csv Thu Oct 12 13:31:32 2023 +0000 @@ -0,0 +1,31 @@ +Compound_Name,Carbon_Number,RT +Undecane,11,124.8 +Dodecane,12,145.8 +Tridecane,13,165 +Tetradecane,14,184.8 +Pentadecane,15,204 +Hexadecane,16,222.6 +Heptadecane,17,245.4 +Octadecane,18,268.8 +Nonadecane,19,288 +Eicosane,20,307.2 +Uncosane,21,325.2 +Docosane,22,341.4 +Tricosane,23,359.4 +Tetracosane,24,377.4 +Pentacosane,25,393.6 +Hexacosane,26,408 +Heptacosane,27,420.6 +Octacosane,28,432 +Nonacosane,29,442.2 +Triacontane,30,453 +Untriacontane,31,463.2 +Dotriacontane,32,474.6 +Tritriacontane,33,487.2 +Tetrtriacontane,34,501 +Pentatriacontane,35,517.2 +Hexatricontane,36,535.2 +Heptatriacontane,37,556.2 +Octatriacontane,38,580.2 +Nonatriacontane,39,609 +Tetracontane,40,642.6
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/test-data/aplcms_aligned_peaks.csv Thu Oct 12 13:31:32 2023 +0000 @@ -0,0 +1,3844 @@ 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