Mercurial > repos > bimib > cobraxy
diff COBRAxy/custom_data_generator.xml @ 4:41f35c2f0c7b draft
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author | luca_milaz |
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date | Wed, 18 Sep 2024 10:59:10 +0000 |
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children | deb6d3439342 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/COBRAxy/custom_data_generator.xml Wed Sep 18 10:59:10 2024 +0000 @@ -0,0 +1,62 @@ +<tool id="CustomDataGenerator" name="Custom Data Generator" version="2.0.0"> + + <macros> + <import>marea_macros.xml</import> + </macros> + + <requirements> + <requirement type="package" version="1.24.4">numpy</requirement> + <requirement type="package" version="2.0.3">pandas</requirement> + <requirement type="package" version="0.29.0">cobra</requirement> + <requirement type="package" version="5.2.2">lxml</requirement> + </requirements> + + <command detect_errors="exit_code"> + <![CDATA[ + python $__tool_directory__/custom_data_generator.py + --input $input + --name $input.element_identifier + --output_format $output_format + --out_log $log + ]]> + </command> + <inputs> + <param name="input" argument="--input" type="data" format="xml, json" label="Custom model:" /> + <param name="name" argument="--name" type="text" label="Model's name:" value="Model" help="Default: Model" /> + + <param name="output_format" argument="--output_format" type="select" label="Output files format:"> + <option value="p" selected="true">pickle extension (binary, non-editable, pre-parsed)</option> + <option value="csv">Comma Separated Values (csv text file, editable, raw)</option> + </param> + </inputs> + + <outputs> + <data format="txt" name="log" label="CustomDataGenerator - $name - Log" /> + + <collection name="results" type="list" label="Custom Data Results ($output_format)"> + <discover_datasets name = "collection" pattern="__name_and_ext__" directory="result"/> + </collection> + </outputs> + + <help> + <![CDATA[ +What it does +------------- + +This tool generates two files containing reactions and rules respectively, starting from a custom model in JSON or XML format, that can be used as inputs for the RAS and RPS generator modules. + +Accepted files: + - A model: JSON or XML file reporting reactions and rules contained in the model. + + +Output: +------------- + +The tool generates: + - rules: reporting the rules for each reaction in the custom model given. Format: csv or pickle. + - reactions: reporting the reactions in the custom model given. Format: csv or pickle. + - a log file (.txt). + ]]> + </help> + <expand macro="citations" /> +</tool> \ No newline at end of file