comparison ProteinQuantifier.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
comparison
equal deleted inserted replaced
3:ec62782f6c68 4:6ead64a594bd
1 <?xml version='1.0' encoding='UTF-8'?> 1 <?xml version="1.0" encoding="UTF-8"?>
2 <tool id="ProteinQuantifier" name="ProteinQuantifier" version="1.12.0"> 2 <!--This is a configuration file for the integration of a tools into Galaxy (https://galaxyproject.org/). This file was automatically generated using CTD2Galaxy.-->
3 <description>Compute peptide and protein abundances</description> 3 <!--Proposed Tool Section: [Quantitation]-->
4 <macros> 4 <tool id="ProteinQuantifier" name="ProteinQuantifier" version="2.0.0">
5 <token name="@EXECUTABLE@">ProteinQuantifier</token> 5 <description>Compute peptide and protein abundances</description>
6 <import>macros.xml</import> 6 <macros>
7 </macros> 7 <token name="@EXECUTABLE@">ProteinQuantifier</token>
8 <expand macro="stdio"/> 8 <import>macros.xml</import>
9 <expand macro="requirements"/> 9 </macros>
10 <command>ProteinQuantifier 10 <expand macro="references"/>
11 <expand macro="stdio"/>
12 <expand macro="requirements"/>
13 <command>ProteinQuantifier
11 14
12 -in ${param_in} 15 #if $param_in:
13 -protxml ${param_protxml} 16 -in $param_in
14 -out ${param_out} 17 #end if
15 -peptide_out ${param_peptide_out} 18 #if $param_protein_groups:
16 -mzTab_out ${param_mzTab_out} 19 -protein_groups $param_protein_groups
17 -top ${param_top} 20 #end if
18 -average ${param_average} 21 #if $param_out:
19 ${param_include_all} 22 -out $param_out
20 ${param_filter_charge} 23 #end if
21 ${param_ratios} 24 #if $param_peptide_out:
22 ${param_ratiosSILAC} 25 -peptide_out $param_peptide_out
23 -threads \${GALAXY_SLOTS:-24} 26 #end if
24 ${param_normalize} 27 #if $param_top:
25 ${param_fix_peptides} 28 -top $param_top
26 -format:separator ${param_separator} 29 #end if
27 -format:quoting ${param_quoting} 30 #if $param_average:
28 -format:replacement ${param_replacement} 31 -average
32 #if &quot; &quot; in str($param_average):
33 &quot;$param_average&quot;
34 #else
35 $param_average
36 #end if
37 #end if
38 #if $param_include_all:
39 -include_all
40 #end if
41 #if $param_filter_charge:
42 -filter_charge
43 #end if
44 #if $param_ratios:
45 -ratios
46 #end if
47 #if $param_ratiosSILAC:
48 -ratiosSILAC
49 #end if
50 -threads \${GALAXY_SLOTS:-24}
51 #if $param_consensus_normalize:
52 -consensus:normalize
53 #end if
54 #if $param_consensus_fix_peptides:
55 -consensus:fix_peptides
56 #end if
57 #if $param_format_separator:
58 -format:separator &quot;$param_format_separator&quot;
59 #end if
60 #if $param_format_quoting:
61 -format:quoting
62 #if &quot; &quot; in str($param_format_quoting):
63 &quot;$param_format_quoting&quot;
64 #else
65 $param_format_quoting
66 #end if
67 #end if
68 #if $param_format_replacement:
69 -format:replacement &quot;$param_format_replacement&quot;
70 #end if
71 #if $adv_opts.adv_opts_selector=='advanced':
72 #if $adv_opts.param_force:
73 -force
74 #end if
75 #end if
29 </command> 76 </command>
30 <inputs> 77 <inputs>
31 <param name="param_in" type="data" format="featureXML,consensusXML,idXML" optional="False" label="Input file" help="(-in)"/> 78 <param format="xml,consensusxml" help="(-in) " label="Input file" name="param_in" optional="False" type="data"/>
32 <param name="param_protxml" type="data" format="idXML" optional="True" label="ProteinProphet results (protXML converted to idXML) for the identification runs that were used to annotate the input.#br#Information about indistinguishable proteins will be used for protein quantification." help="(-protxml)"/> 79 <param format="xml" help="(-protein_groups) e.g. from ProteinProphet via IDFileConverter or Fido via FidoAdapter). &lt;br&gt;Information about indistinguishable proteins will be used for protein quantification" label="Protein inference results for the identification runs that were used to annotate the input (" name="param_protein_groups" optional="True" type="data"/>
33 <param name="param_top" type="integer" min="0" optional="True" value="3" label="Calculate protein abundance from this number of proteotypic peptides (most abundant first; '0' for all)" help="(-top)"/> 80 <param help="(-top) " label="Calculate protein abundance from this number of proteotypic peptides (most abundant first; '0' for all)" min="0" name="param_top" optional="True" type="integer" value="3"/>
34 <param name="param_average" type="select" optional="True" value="median" label="Averaging method used to compute protein abundances from peptide abundances" help="(-average)"> 81 <param help="(-average) " label="Averaging method used to compute protein abundances from peptide abundances" name="param_average" optional="True" type="select" value="median">
35 <option value="median">median</option> 82 <option value="median">median</option>
36 <option value="mean">mean</option> 83 <option value="mean">mean</option>
37 <option value="sum">sum</option> 84 <option value="weighted_mean">weighted_mean</option>
38 </param> 85 <option value="sum">sum</option>
39 <param name="param_include_all" type="boolean" truevalue="-include_all true" falsevalue="-include_all false" checked="false" optional="True" label="Include results for proteins with fewer proteotypic peptides than indicated by 'top' (no effect if 'top' is 0 or 1)" help="(-include_all)"/> 86 </param>
40 <param name="param_filter_charge" type="boolean" truevalue="-filter_charge true" falsevalue="-filter_charge false" checked="false" optional="True" label="Distinguish between charge states of a peptide. For peptides, abundances will be reported separately for each charge;#br#for proteins, abundances will be computed based only on the most prevalent charge of each peptide.#br#By default, abundances are summed over all charge states." help="(-filter_charge)"/> 87 <param checked="false" falsevalue="" help="(-include_all) " label="Include results for proteins with fewer proteotypic peptides than indicated by 'top' (no effect if 'top' is 0 or 1)" name="param_include_all" optional="True" truevalue="-include_all" type="boolean"/>
41 <param name="param_ratios" type="boolean" truevalue="-ratios true" falsevalue="-ratios false" checked="false" optional="True" label="Add the log2 ratios of the abundance values to the output. Format: log_2(x_0/x_0) &lt;sep&gt; log_2(x_1/x_0) &lt;sep&gt; log_2(x_2/x_0) ..." help="(-ratios)"/> 88 <param checked="false" falsevalue="" help="(-filter_charge) For peptides, abundances will be reported separately for each charge; &lt;br&gt;for proteins, abundances will be computed based only on the most prevalent charge of each peptide. &lt;br&gt;By default, abundances are summed over all charge states" label="Distinguish between charge states of a peptide" name="param_filter_charge" optional="True" truevalue="-filter_charge" type="boolean"/>
42 <param name="param_ratiosSILAC" type="boolean" truevalue="-ratiosSILAC true" falsevalue="-ratiosSILAC false" checked="false" optional="True" label="Add the log2 ratios for a triple SILAC experiment to the output. Only applicable to consensus maps of exactly three sub-maps. Format: log_2(heavy/light) &lt;sep&gt; log_2(heavy/middle) &lt;sep&gt; log_2(middle/light)" help="(-ratiosSILAC)"/> 89 <param checked="false" falsevalue="" help="(-ratios) Format: log_2(x_0/x_0) &lt;sep&gt; log_2(x_1/x_0) &lt;sep&gt; log_2(x_2/x_0) " label="Add the log2 ratios of the abundance values to the output" name="param_ratios" optional="True" truevalue="-ratios" type="boolean"/>
43 <param name="param_normalize" type="boolean" truevalue="-consensus:normalize true" falsevalue="-consensus:normalize false" checked="false" optional="True" label="Scale peptide abundances so that medians of all samples are equal" help="(-normalize)"/> 90 <param checked="false" falsevalue="" help="(-ratiosSILAC) Only applicable to consensus maps of exactly three sub-maps. Format: log_2(heavy/light) &lt;sep&gt; log_2(heavy/middle) &lt;sep&gt; log_2(middle/light)" label="Add the log2 ratios for a triple SILAC experiment to the output" name="param_ratiosSILAC" optional="True" truevalue="-ratiosSILAC" type="boolean"/>
44 <param name="param_fix_peptides" type="boolean" truevalue="-consensus:fix_peptides true" falsevalue="-consensus:fix_peptides false" checked="false" optional="True" label="Use the same peptides for protein quantification across all samples.#br#With 'top 0', all peptides that occur in every sample are considered.#br#Otherwise ('top N'), the N peptides that occur in the most samples (independently of each other) are selected,#br#breaking ties by total abundance (there is no guarantee that the best co-ocurring peptides are chosen!)." help="(-fix_peptides)"/> 91 <param checked="false" falsevalue="" help="(-normalize) " label="Scale peptide abundances so that medians of all samples are equal" name="param_consensus_normalize" optional="True" truevalue="-consensus:normalize" type="boolean"/>
45 <param name="param_separator" type="text" size="20" label="Character(s) used to separate fields; by default, the 'tab' character is used" help="(-separator)"/> 92 <param checked="false" falsevalue="" help="(-fix_peptides) &lt;br&gt;With 'top 0', all peptides that occur in every sample are considered. &lt;br&gt;Otherwise ('top N'), the N peptides that occur in the most samples (independently of each other) are selected, &lt;br&gt;breaking ties by total abundance (there is no guarantee that the best co-ocurring peptides are chosen!)" label="Use the same peptides for protein quantification across all samples" name="param_consensus_fix_peptides" optional="True" truevalue="-consensus:fix_peptides" type="boolean"/>
46 <param name="param_quoting" type="select" optional="True" value="double" label="Method for quoting of strings: 'none' for no quoting, 'double' for quoting with doubling of embedded quotes,#br#'escape' for quoting with backslash-escaping of embedded quotes" help="(-quoting)"> 93 <param help="(-separator) " label="Character(s) used to separate fields; by default, the 'tab' character is used" name="param_format_separator" size="30" type="text">
47 <option value="none">none</option> 94 <sanitizer>
48 <option value="double">double</option> 95 <valid initial="string.printable">
49 <option value="escape">escape</option> 96 <remove value="'"/>
50 </param> 97 <remove value="&quot;"/>
51 <param name="param_replacement" type="text" size="20" value="_" label="If 'quoting' is 'none', used to replace occurrences of the separator in strings before writing" help="(-replacement)"/> 98 </valid>
52 </inputs> 99 </sanitizer>
53 <outputs> 100 </param>
54 <data name="param_out" label="Output file for protein abundances" format="tabular"/> 101 <param help="(-quoting) " label="Method for quoting of strings: 'none' for no quoting, 'double' for quoting with doubling of embedded quotes, &lt;br&gt;'escape' for quoting with backslash-escaping of embedded quotes" name="param_format_quoting" optional="True" type="select" value="double">
55 <data name="param_peptide_out" label="Output file for peptide abundances" format="tabular"/> 102 <option value="none">none</option>
56 <data name="param_mzTab_out" label="Export to mzTab.#br#Either 'out', 'peptide_out', or 'mzTab_out' are required. They can be used together." format="tabular"/> 103 <option value="double">double</option>
57 </outputs> 104 <option value="escape">escape</option>
58 <help>**What it does** 105 </param>
59 106 <param help="(-replacement) " label="If 'quoting' is 'none', used to replace occurrences of the separator in strings before writing" name="param_format_replacement" size="30" type="text" value="_">
60 Compute peptide and protein abundances 107 <sanitizer>
108 <valid initial="string.printable">
109 <remove value="'"/>
110 <remove value="&quot;"/>
111 </valid>
112 </sanitizer>
113 </param>
114 <expand macro="advanced_options">
115 <param checked="false" falsevalue="" help="(-force) " label="Overwrite tool specific checks" name="param_force" optional="True" truevalue="-force" type="boolean"/>
116 </expand>
117 </inputs>
118 <outputs>
119 <data format="tabular" name="param_out"/>
120 <data format="tabular" name="param_peptide_out"/>
121 </outputs>
122 <help>Compute peptide and protein abundances
61 123
62 124
63 For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/TOPP_ProteinQuantifier.html 125 For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/TOPP_ProteinQuantifier.html</help>
64 126 </tool>
65 @REFERENCES@
66 </help>
67 </tool>