Mercurial > repos > bgruening > openms
diff MRMPairFinder.xml @ 4:6ead64a594bd draft default tip
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/openms commit 7a5239910fda9ed90cca286a38855703b40b1b56-dirty
| author | bgruening |
|---|---|
| date | Wed, 27 Jan 2016 10:06:49 -0500 |
| parents | 3d84209d3178 |
| children |
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--- a/MRMPairFinder.xml Mon Oct 13 10:18:22 2014 -0400 +++ b/MRMPairFinder.xml Wed Jan 27 10:06:49 2016 -0500 @@ -1,45 +1,61 @@ -<?xml version='1.0' encoding='UTF-8'?> -<tool id="MRMPairFinder" name="MRMPairFinder" version="1.12.0"> - <description>Util which can be used to evaluate labeled pair ratios on MRM features.</description> - <macros> - <token name="@EXECUTABLE@">MRMPairFinder</token> - <import>macros.xml</import> - </macros> - <expand macro="stdio"/> - <expand macro="requirements"/> - <command>MRMPairFinder +<?xml version="1.0" encoding="UTF-8"?> + <!--This is a configuration file for the integration of a tools into Galaxy (https://galaxyproject.org/). This file was automatically generated using CTD2Galaxy.--> + <!--Proposed Tool Section: [Utilities]--> + <tool id="MRMPairFinder" name="MRMPairFinder" version="2.0.0"> + <description>Util which can be used to evaluate labeled pair ratios on MRM features.</description> + <macros> + <token name="@EXECUTABLE@">MRMPairFinder</token> + <import>macros.xml</import> + </macros> + <expand macro="references"/> + <expand macro="stdio"/> + <expand macro="requirements"/> + <command>MRMPairFinder --in ${param_in} --pair_in ${param_pair_in} --out ${param_out} --feature_out ${param_feature_out} --threads \${GALAXY_SLOTS:-24} +#if $param_in: + -in $param_in +#end if +#if $param_pair_in: + -pair_in $param_pair_in +#end if +#if $param_out: + -out $param_out +#end if +#if $param_feature_out: + -feature_out $param_feature_out +#end if +-threads \${GALAXY_SLOTS:-24} #if $adv_opts.adv_opts_selector=='advanced': - -mass_tolerance ${adv_opts.param_mass_tolerance} - -RT_tolerance ${adv_opts.param_RT_tolerance} - -RT_pair_tolerance ${adv_opts.param_RT_pair_tolerance} + #if $adv_opts.param_mass_tolerance: + -mass_tolerance $adv_opts.param_mass_tolerance +#end if + #if $adv_opts.param_RT_tolerance: + -RT_tolerance $adv_opts.param_RT_tolerance +#end if + #if $adv_opts.param_RT_pair_tolerance: + -RT_pair_tolerance $adv_opts.param_RT_pair_tolerance +#end if + #if $adv_opts.param_force: + -force +#end if #end if </command> - <inputs> - <param name="param_in" type="data" format="featureXML" optional="False" label="Input featureXML file containing the features of the MRM experiment spectra." help="(-in)"/> - <param name="param_pair_in" type="data" format="tabular" optional="False" label="Pair-file in the format: prec-m/z-light prec-m/z-heavy frag-m/z-light frag-m/z-heavy rt" help="(-pair_in)"/> - <expand macro="advanced_options"> - <param name="param_mass_tolerance" type="float" min="0.0" optional="True" value="0.01" label="Precursor mass tolerance which is used for the pair finding and the matching of the given pair m/z values to the features." help="(-mass_tolerance)"/> - <param name="param_RT_tolerance" type="float" min="0.0" optional="True" value="200.0" label="Maximal deviation in RT dimension in seconds a feature can have when comparing to the RT values given in the pair file." help="(-RT_tolerance)"/> - <param name="param_RT_pair_tolerance" type="float" min="0.0" optional="True" value="5.0" label="Maximal deviation in RT dimension in seconds the two partners of a pair is allowed to have." help="(-RT_pair_tolerance)"/> - </expand> - </inputs> - <outputs> - <data name="param_out" label="Output consensusXML file were the pairs of the features will be written to." format="consensusXML"/> - <data name="param_feature_out" label="Output featureXML file, only written if given, skipped otherwise." format="featureXML"/> - </outputs> - <help>**What it does** - -Util which can be used to evaluate labeled pair ratios on MRM features. + <inputs> + <param format="xml" help="(-in) " label="Input featureXML file containing the features of the MRM experiment spectra" name="param_in" optional="False" type="data"/> + <param format="tabular" help="(-pair_in) " label="Pair-file in the format: prec-m/z-light prec-m/z-heavy frag-m/z-light frag-m/z-heavy rt" name="param_pair_in" optional="False" type="data"/> + <expand macro="advanced_options"> + <param help="(-mass_tolerance) " label="Precursor mass tolerance which is used for the pair finding and the matching of the given pair m/z values to the features" min="0.0" name="param_mass_tolerance" optional="True" type="float" value="0.01"/> + <param help="(-RT_tolerance) " label="Maximal deviation in RT dimension in seconds a feature can have when comparing to the RT values given in the pair file" min="0.0" name="param_RT_tolerance" optional="True" type="float" value="200.0"/> + <param help="(-RT_pair_tolerance) " label="Maximal deviation in RT dimension in seconds the two partners of a pair is allowed to have" min="0.0" name="param_RT_pair_tolerance" optional="True" type="float" value="5.0"/> + <param checked="false" falsevalue="" help="(-force) " label="Overwrite tool specific checks" name="param_force" optional="True" truevalue="-force" type="boolean"/> + </expand> + </inputs> + <outputs> + <data format="consensusxml" name="param_out"/> + <data format="xml" name="param_feature_out"/> + </outputs> + <help>Util which can be used to evaluate labeled pair ratios on MRM features. -For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/UTILS_MRMPairFinder.html - -@REFERENCES@ -</help> -</tool> +For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/UTILS_MRMPairFinder.html</help> + </tool>
