Mercurial > repos > metexplore > met4j

annotate build/tools/SetEcNumbers/SetEcNumbers.xml @ 9:0976a6257300 draft

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planemo upload for repository https://forgemia.inra.fr/metexplore/met4j-galaxy commit 05db35f63cadb9d56dafff594a3507c59cd85273
author metexplore
date Fri, 31 Jan 2025 18:28:53 +0000
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1 <?xml version="1.0" encoding="UTF-8" standalone="no"?>
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2 <tool id="met4j_SetEcNumbers" name="SetEcNumbers" version="develop">
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3 <description>Set EC numbers to reactions in a SBML file from a tabulated file containing the reaction ids and the EC numbers</description>
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4 <xrefs>
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5 <xref type="bio.tools">met4j</xref>
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6 </xrefs>
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7 <requirements>
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8 <container type="singularity">oras://registry.forgemia.inra.fr/metexplore/met4j/met4j-singularity:develop</container>
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9 </requirements>
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10 <command detect_errors="exit_code"><![CDATA[sh /usr/bin/met4j.sh attributes.SetEcNumbers#if str($colec) != 'nan':
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11 -cec "$colec"
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12 #end if
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13 #if str($colid) != 'nan':
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14 -ci "$colid"
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15 #end if
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16 $p
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17 #if str($nSkip):
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18 -n "$nSkip"
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19 #end if
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20 -i "$sbml"
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21 #if str($tab) != 'None':
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22 -tab "$tab"
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23 #end if
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24 #if str($c):
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25 -c "$c"
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26 #end if
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27 -o "$out"
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28 ]]></command>
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29 <inputs>
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30 <param argument="-cec" label="[2] number of the column where are the ecs" name="colec" optional="true" type="integer" value="2"/>
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31 <param argument="-ci" label="[1] number of the column where are the reaction ids" name="colid" optional="true" type="integer" value="1"/>
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32 <param argument="-p" checked="false" falsevalue="" label="[deactivated] To match the objects in the sbml file, adds the prefix R_ to reactions" name="p" truevalue="-p" type="boolean" value="false"/>
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33 <param argument="-n" label="[0] Number of lines to skip at the beginning of the tabulated file" name="nSkip" optional="true" type="text" value="0">
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34 <sanitizer invalid_char="_">
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35 <valid initial="string.printable"/>
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36 </sanitizer>
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37 </param>
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38 <param argument="-i" format="sbml" label="Original SBML file" name="sbml" optional="false" type="data" value=""/>
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39 <param argument="-tab" format="tsv" label="Input Tabulated file" name="tab" optional="true" type="data" value=""/>
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40 <param argument="-c" label="[#] Comment String in the tabulated file. The lines beginning by this string won't be read" name="c" optional="true" type="text" value="#">
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41 <sanitizer invalid_char="_">
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42 <valid initial="string.printable"/>
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43 </sanitizer>
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44 </param>
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45 </inputs>
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46 <outputs>
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47 <data format="sbml" name="out"/>
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48 </outputs>
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49 <tests>
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50 <test>
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51
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57 <param name="sbml" value="toy_model.xml"/>
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64 <param name="tab" value="ec.tsv"/>
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71 <output ftype="sbml" name="out">
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78 <assert_contents>
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85 <is_valid_xml/>
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92 <has_line_matching expression=".*1.1.1.1.*" n="2"/>
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99 <has_line_matching expression=".*1.2.3.4.*" n="2"/>
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104
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105
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106 </assert_contents>
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107
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108
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109
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111
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112
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113 </output>
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115
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116
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117
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119
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120 </test>
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121 <test expect_failure="true">
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122
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123
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124
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125
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126
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127
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128 <param name="sbml" value="toy_model.xml"/>
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129
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133
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134
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135 <param name="tab" value="ecBad.tsv"/>
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141
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142 </test>
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143 </tests>
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144 <help><![CDATA[Set EC numbers to reactions in a SBML file from a tabulated file containing the reaction ids and the EC numbers
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145 The ids must correspond between the tabulated file and the SBML file.
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146 If prefix R_ is present in the ids in the SBML file and not in the tabulated file, use the -p option.
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147 The EC will be written in the SBML file in two locations:
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148 - in the reaction HTML notes (e.g. EC_NUMBER: 2.4.2.14)
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149 - as a reaction MIRIAM annotation (see https://pubmed.ncbi.nlm.nih.gov/16333295/) with ec-code identifiers link (https://registry.identifiers.org/registry/ec-code)]]></help>
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150 <citations>
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151 <citation type="doi">10.1038/nbt1156</citation>
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152 </citations>
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153 </tool>