Mercurial > repos > galaxyp > openms
diff MRMPairFinder.xml @ 0:3070d71e0e5c draft
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| author | bgruening |
|---|---|
| date | Thu, 16 Apr 2015 08:37:04 -0400 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/MRMPairFinder.xml Thu Apr 16 08:37:04 2015 -0400 @@ -0,0 +1,61 @@ +<?xml version='1.0' encoding='UTF-8'?> +<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="stdio"/> + <expand macro="requirements"/> + <command>MRMPairFinder + +#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': + #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) "/> + <param name="param_force" type="boolean" truevalue="-force" falsevalue="" checked="false" optional="True" label="Overwrite tool specific checks" help="(-force) "/> + </expand> + </inputs> + <outputs> + <data name="param_out" format="consensusxml"/> + <data name="param_feature_out" format="featurexml"/> + </outputs> + <help>**What it does** + +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</help> + <expand macro="references"/> +</tool>
