Mercurial > repos > galaxyp > openms_erpairfinder
diff ERPairFinder.xml @ 0:434e2afd1d8a draft
planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/openms commit fb85d488133bb2b5f483b52b2db0ac66038fafb8
author | galaxyp |
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date | Wed, 01 Mar 2017 12:57:35 -0500 |
parents | |
children | 1cc2379045c3 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/ERPairFinder.xml Wed Mar 01 12:57:35 2017 -0500 @@ -0,0 +1,72 @@ +<?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="ERPairFinder" name="ERPairFinder" version="2.1.0"> + <description>Util which can be used to evaluate pair ratios on enhanced resolution (zoom) scans.</description> + <macros> + <token name="@EXECUTABLE@">ERPairFinder</token> + <import>macros.xml</import> + </macros> + <expand macro="references"/> + <expand macro="stdio"/> + <expand macro="requirements"/> + <command>ERPairFinder + +#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 +#if $param_precursor_mass_tolerance: + -precursor_mass_tolerance $param_precursor_mass_tolerance +#end if +#if $adv_opts.adv_opts_selector=='advanced': + #if $adv_opts.param_RT_tolerance: + -RT_tolerance $adv_opts.param_RT_tolerance +#end if + #if $adv_opts.param_max_charge: + -max_charge $adv_opts.param_max_charge +#end if + #if $adv_opts.param_intensity_threshold: + -intensity_threshold $adv_opts.param_intensity_threshold +#end if + #if $adv_opts.param_max_isotope: + -max_isotope $adv_opts.param_max_isotope +#end if + #if $adv_opts.param_expansion_range: + -expansion_range $adv_opts.param_expansion_range +#end if + #if $adv_opts.param_force: + -force +#end if +#end if +</command> + <inputs> + <param name="param_in" type="data" format="mzml" optional="False" label="Input mzML file containing the ER spectra" help="(-in) "/> + <param name="param_pair_in" type="data" format="txt" optional="False" label="Pair-file in the format: m/z-light m/z-heavy charge rt" help="(-pair_in) "/> + <param name="param_precursor_mass_tolerance" type="float" min="0.0" optional="True" value="0.3" 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="(-precursor_mass_tolerance) "/> + <expand macro="advanced_options"> + <param name="param_RT_tolerance" type="float" min="1.0" 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_max_charge" type="integer" min="1" optional="True" value="3" label="Maximal charge state features should be search fo" help="(-max_charge) "/> + <param name="param_intensity_threshold" type="float" min="-1.0" optional="True" value="-1.0" label="Intensity threshold, for the meaning see the documentation of the IsotopeWaveletFeatureFinder documentation" help="(-intensity_threshold) "/> + <param name="param_max_isotope" type="integer" min="2" optional="True" value="3" label="Max isotope of the isotope distribution to be considered" help="(-max_isotope) "/> + <param name="param_expansion_range" type="float" min="0.0" optional="True" value="5.0" label="The range that is used to extend the isotope distribution with null intensity peaks in Th" help="(-expansion_range) "/> + <param name="param_force" display="radio" 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>Util which can be used to evaluate pair ratios on enhanced resolution (zoom) scans. + + +For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/UTILS_ERPairFinder.html</help> +</tool>