Mercurial > repos > recetox > riassigner
comparison riassigner.xml @ 7:984d5fa7acf5 draft default tip
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/riassigner commit 059cad0b3f5f7067d0ca577bfe7e29bfca8af6b5
| author | recetox |
|---|---|
| date | Thu, 14 Aug 2025 14:01:09 +0000 |
| parents | af25aa61c611 |
| children |
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| 6:af25aa61c611 | 7:984d5fa7acf5 |
|---|---|
| 1 <tool id="riassigner" name="RIAssigner" version="@TOOL_VERSION@+galaxy0" profile="21.09"> | 1 <tool id="riassigner" name="RIAssigner" version="@TOOL_VERSION@+galaxy1" profile="21.09"> |
| 2 <description>compute retention indices</description> | 2 <description>compute retention indices</description> |
| 3 <macros> | 3 <macros> |
| 4 <import>macros.xml</import> | 4 <import>macros.xml</import> |
| 5 </macros> | 5 </macros> |
| 6 <expand macro="creator"/> | 6 <expand macro="creator"/> |
| 53 <option value="cubicspline">CubicSpline</option> | 53 <option value="cubicspline">CubicSpline</option> |
| 54 </param> | 54 </param> |
| 55 </inputs> | 55 </inputs> |
| 56 | 56 |
| 57 <outputs> | 57 <outputs> |
| 58 <data label="RI using $method of ${query_section.query.element_identifier}" name="output" format="tsv" | 58 <data label="${query_section.query.element_identifier} with RI" name="output" format="tsv" |
| 59 metadata_source="query"> | 59 metadata_source="query"> |
| 60 <change_format> | 60 <change_format> |
| 61 <when input="query_section.query.ext" value="msp" format="msp" /> | 61 <when input="query_section.query.ext" value="msp" format="msp" /> |
| 62 </change_format> | 62 </change_format> |
| 63 </data> | 63 </data> |
| 64 </outputs> | 64 </outputs> |
| 65 | 65 |
| 66 <tests> | 66 <tests> |
| 67 <test> | 67 <test> |
| 68 <param name="query" value="aplcms_aligned_peaks.csv" ftype="csv"/> | 68 <section name="query_section"> |
| 69 <param name="query_rt_units" value="seconds"/> | 69 <param name="query" value="aplcms_aligned_peaks.csv" ftype="csv"/> |
| 70 <param name="reference" value="Alkanes_20210325.csv" ftype="csv"/> | 70 <param name="query_rt_units" value="seconds"/> |
| 71 <param name="reference_rt_units" value="seconds"/> | 71 </section> |
| 72 <section name="reference_section"> | |
| 73 <param name="reference" value="Alkanes_20210325.csv" ftype="csv"/> | |
| 74 <param name="reference_rt_units" value="seconds"/> | |
| 75 </section> | |
| 72 <param name="method" value="kovats"/> | 76 <param name="method" value="kovats"/> |
| 73 <output name="output" file="results.tsv" ftype="tsv"/> | 77 <output name="output" file="results.tsv" ftype="tsv"/> |
| 74 </test> | 78 </test> |
| 75 </tests> | 79 </tests> |
| 76 | 80 |
