Mercurial > repos > bgruening > openms
diff MRMPairFinder.xml @ 0:3d84209d3178 draft
Uploaded
| author | bgruening |
|---|---|
| date | Fri, 10 Oct 2014 18:20:03 -0400 |
| parents | |
| children | 6ead64a594bd |
line wrap: on
line diff
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/MRMPairFinder.xml Fri Oct 10 18:20:03 2014 -0400 @@ -0,0 +1,45 @@ +<?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 + +-in ${param_in} +-pair_in ${param_pair_in} +-out ${param_out} +-feature_out ${param_feature_out} +-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} +#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. + + +For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/UTILS_MRMPairFinder.html + +@REFERENCES@ +</help> +</tool>
