diff FeatureLinkerUnlabeledQT.xml @ 0:95b2f6a72817 draft

planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/openms commit fb85d488133bb2b5f483b52b2db0ac66038fafb8
author galaxyp
date Wed, 01 Mar 2017 12:25:29 -0500
parents
children 09d268b81f88
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/FeatureLinkerUnlabeledQT.xml	Wed Mar 01 12:25:29 2017 -0500
@@ -0,0 +1,103 @@
+<?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: [Map Alignment]-->
+<tool id="FeatureLinkerUnlabeledQT" name="FeatureLinkerUnlabeledQT" version="2.1.0">
+  <description>Groups corresponding features from multiple maps.</description>
+  <macros>
+    <token name="@EXECUTABLE@">FeatureLinkerUnlabeledQT</token>
+    <import>macros.xml</import>
+  </macros>
+  <expand macro="references"/>
+  <expand macro="stdio"/>
+  <expand macro="requirements"/>
+  <command>FeatureLinkerUnlabeledQT
+
+-in
+  #for token in $param_in:
+    $token
+  #end for
+#if $param_out:
+  -out $param_out
+#end if
+#if $param_keep_subelements:
+  -keep_subelements
+#end if
+#if $param_algorithm_use_identifications:
+  -algorithm:use_identifications
+#end if
+#if $param_algorithm_nr_partitions:
+  -algorithm:nr_partitions $param_algorithm_nr_partitions
+#end if
+#if $param_algorithm_ignore_charge:
+  -algorithm:ignore_charge
+#end if
+#if $param_algorithm_distance_RT_max_difference:
+  -algorithm:distance_RT:max_difference $param_algorithm_distance_RT_max_difference
+#end if
+#if $param_algorithm_distance_MZ_max_difference:
+  -algorithm:distance_MZ:max_difference $param_algorithm_distance_MZ_max_difference
+#end if
+#if $param_algorithm_distance_MZ_unit:
+  -algorithm:distance_MZ:unit $param_algorithm_distance_MZ_unit
+#end if
+#if $adv_opts.adv_opts_selector=='advanced':
+    #if $adv_opts.param_force:
+  -force
+#end if
+    #if $adv_opts.param_algorithm_distance_RT_exponent:
+  -algorithm:distance_RT:exponent $adv_opts.param_algorithm_distance_RT_exponent
+#end if
+    #if $adv_opts.param_algorithm_distance_RT_weight:
+  -algorithm:distance_RT:weight $adv_opts.param_algorithm_distance_RT_weight
+#end if
+    #if $adv_opts.param_algorithm_distance_MZ_exponent:
+  -algorithm:distance_MZ:exponent $adv_opts.param_algorithm_distance_MZ_exponent
+#end if
+    #if $adv_opts.param_algorithm_distance_MZ_weight:
+  -algorithm:distance_MZ:weight $adv_opts.param_algorithm_distance_MZ_weight
+#end if
+    #if $adv_opts.param_algorithm_distance_intensity_exponent:
+  -algorithm:distance_intensity:exponent $adv_opts.param_algorithm_distance_intensity_exponent
+#end if
+    #if $adv_opts.param_algorithm_distance_intensity_weight:
+  -algorithm:distance_intensity:weight $adv_opts.param_algorithm_distance_intensity_weight
+#end if
+#end if
+</command>
+  <inputs>
+    <param name="param_in" type="data" format="featurexml,consensusxml" multiple="true" optional="False" size="30" label="input files separated by blanks" help="(-in) ">
+      <sanitizer>
+        <valid initial="string.printable">
+          <remove value="'"/>
+          <remove value="&quot;"/>
+        </valid>
+      </sanitizer>
+    </param>
+    <param name="param_keep_subelements" display="radio" type="boolean" truevalue="-keep_subelements" falsevalue="" checked="false" optional="True" label="For consensusXML input only: If set, the sub-features of the inputs are transferred to the output" help="(-keep_subelements) "/>
+    <param name="param_algorithm_use_identifications" display="radio" type="boolean" truevalue="-algorithm:use_identifications" falsevalue="" checked="false" optional="True" label="Never link features that are annotated with different peptides (only the best hit per peptide identification is taken into account)" help="(-use_identifications) "/>
+    <param name="param_algorithm_nr_partitions" type="integer" min="1" optional="True" value="1" label="How many partitions in m/z space should be used for the algorithm (more partitions means faster runtime and more memory efficient execution )" help="(-nr_partitions) "/>
+    <param name="param_algorithm_ignore_charge" display="radio" type="boolean" truevalue="-algorithm:ignore_charge" falsevalue="" checked="false" optional="True" label="false [default]: pairing requires equal charge state (or at least one unknown charge '0'); true: Pairing irrespective of charge state" help="(-ignore_charge) "/>
+    <param name="param_algorithm_distance_RT_max_difference" type="float" min="0.0" optional="True" value="100.0" label="Never pair features with a larger RT distance (in seconds)" help="(-max_difference) "/>
+    <param name="param_algorithm_distance_MZ_max_difference" type="float" min="0.0" optional="True" value="0.3" label="Never pair features with larger m/z distance (unit defined by 'unit')" help="(-max_difference) "/>
+    <param name="param_algorithm_distance_MZ_unit" display="radio" type="select" optional="False" value="Da" label="Unit of the 'max_difference' paramete" help="(-unit) ">
+      <option value="Da" selected="true">Da</option>
+      <option value="ppm">ppm</option>
+    </param>
+    <expand macro="advanced_options">
+      <param name="param_force" display="radio" type="boolean" truevalue="-force" falsevalue="" checked="false" optional="True" label="Overwrite tool specific checks" help="(-force) "/>
+      <param name="param_algorithm_distance_RT_exponent" type="float" min="0.0" optional="True" value="1.0" label="Normalized RT differences ([0-1], relative to 'max_difference') are raised to this power (using 1 or 2 will be fast, everything else is REALLY slow)" help="(-exponent) "/>
+      <param name="param_algorithm_distance_RT_weight" type="float" min="0.0" optional="True" value="1.0" label="Final RT distances are weighted by this facto" help="(-weight) "/>
+      <param name="param_algorithm_distance_MZ_exponent" type="float" min="0.0" optional="True" value="2.0" label="Normalized ([0-1], relative to 'max_difference') m/z differences are raised to this power (using 1 or 2 will be fast, everything else is REALLY slow)" help="(-exponent) "/>
+      <param name="param_algorithm_distance_MZ_weight" type="float" min="0.0" optional="True" value="1.0" label="Final m/z distances are weighted by this facto" help="(-weight) "/>
+      <param name="param_algorithm_distance_intensity_exponent" type="float" min="0.0" optional="True" value="1.0" label="Differences in relative intensity ([0-1]) are raised to this power (using 1 or 2 will be fast, everything else is REALLY slow)" help="(-exponent) "/>
+      <param name="param_algorithm_distance_intensity_weight" type="float" min="0.0" optional="True" value="0.0" label="Final intensity distances are weighted by this facto" help="(-weight) "/>
+    </expand>
+  </inputs>
+  <outputs>
+    <data name="param_out" format="consensusxml"/>
+  </outputs>
+  <help>Groups corresponding features from multiple maps.
+
+
+For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/TOPP_FeatureLinkerUnlabeledQT.html</help>
+</tool>