comparison extract_rmsd.xml @ 2:589f8ef21e58 draft default tip

"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f1c3c88c7395f2e84cbc533199406aadb79c5c07"

1:8f6ad93973cb

<tool id="mdanalysis_extract_rmsd" name="Extract RMSD distance matrix data" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
    <description>from MD ensemble with MDAnalysis</description>
    <macros>
        <import>macros.xml</import>
        <token name="@GALAXY_VERSION@">1</token>
    </macros>
    <expand macro="requirements"/>
    <command detect_errors="exit_code"><![CDATA[
        #for t in $strs:
            echo $t &>> ./strs.txt &&

            <param name="start" value="0" />
            <param name="end" value="15" />
            <param name="step" value="1" />
            <output name="output"> 
                <assert_contents>
                    <has_text text="0.0" n="20"/>
                    <has_size value="1126" />
                    <has_n_lines n="74" />
                </assert_contents>
            </output>
        </test>

2:589f8ef21e58

<tool id="mdanalysis_extract_rmsd" name="Extract RMSD distance matrix data" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
    <description>from MD ensemble with MDAnalysis</description>
    <macros>
        <import>macros.xml</import>
        <token name="@GALAXY_VERSION@">2</token>
    </macros>
    <expand macro="requirements"/>
    <command detect_errors="exit_code"><![CDATA[
        #for t in $strs:
            echo $t &>> ./strs.txt &&

            <param name="start" value="0" />
            <param name="end" value="15" />
            <param name="step" value="1" />
            <output name="output"> 
                <assert_contents>
                    <has_text text="0.0" n="60"/>
                    <has_size value="1126" />
                    <has_n_lines n="74" />
                </assert_contents>
            </output>
        </test>