annotate PDAUG_Uversky_Plot/PDAUG_Uversky_Plot.xml @ 0:070fc1da6df7 draft

"planemo upload for repository https://github.com/jaidevjoshi83/pdaug commit a9bd83f6a1afa6338cb6e4358b63ebff5bed155e"

<tool id="pdaug_uversky_plot" name="PDAUG Uversky Plot" version="0.1.0" python_template_version="3.6">
    <description>Uversky plot to analyze ordered and disordered proteins</description>
    
    <requirements>
      <requirement type="package" version="2.7.18">python</requirement>
      <requirement type="package" version="1.4.6">powerlaw</requirement>
      <requirement type="package" version="0.2.4">quantiprot</requirement>
    </requirements>

    <command detect_errors="exit_code"><![CDATA[

        python '$__tool_directory__/PDAUG_Uversky_Plot.py'  --Fasta1 '$input1' --Fasta2 '$input2' --OutFile 'out.png' 
             
    ]]></command>

    <inputs>
      <param name="input1" type="data" format="fasta" label="First fasta file" argument= "--Fasta1" help="First fasta file with Peptides"/>
      <param name="input2" type="data" format="fasta" label="Second fasta file" argument="--Fasta2"  help="Second fasta file with Peptides"/>
    </inputs>

    <outputs>   
        <data name='output2' format='png' label="${tool.name} on $on_string - (PNG)" from_work_dir="out.png"/>
    </outputs>
 
    <tests>
        <test>
            <param name="input1" value="test1.fasta"/>
            <param name="input2" value="test2.fasta"/>
            <output name="output2" file="out.png"/>
        </test>
    </tests>

    <help><![CDATA[
.. class:: infomark

**What it does**

This plot divides analyze peptide sequences on globular and IDP subsets based on their mean net charge versus mean hydropathy. The line represents the permeable boundary between both subsets.

-----

**Inputs**
    * **--Fasta1** The first fasta file.
    * **--Fasta2** The second fasta file.

-----

**Outputs**
    * Return html file.]]></help>
<citations>
  <citation type="bibtex">
    @misc{PDAUGGITHUB, 
      author = {Joshi, Jayadev  and Blankenberg, Daniel}, 
      year = {2020}, 
      title ={PDAUG - a Galaxy based toolset for peptide library analysis, visualization, and machine learning modeling}, 
      publisher = {GitHub}, 
      journal = {GitHub repository}, 
      url =
      {https://github.com/jaidevjoshi83/pdaug.git}, 
      }
  </citation>

  <citation type="bibtex">
    @article{konopka_marciniak_dyrka_2017,
       title={Quantiprot - a Python package for quantitative analysis of protein sequences}, 
       volume={18},
       DOI={10.1186/s12859-017-1751-4}, 
       number={1}, 
       journal={BMC Bioinformatics},
       author={Konopka, Bogumił M. and Marciniak, Marta and Dyrka, Witold}, 
       year={2017}
     }
  </citation>
</citations>
</tool>