view hhblits.xml @ 2:c3bf37da2daa draft

"planemo upload commit 7d8de143106a5b1e6f1ea7150141567508573f8a-dirty"

<tool id="hhblits" name="HH-blits itererative protein sequence searching" version="0.1.0" python_template_version="3.5">
    <requirements>
        <requirement type="package" version="3.2.0">hhsuite</requirement>
    </requirements>
    <command detect_errors="exit_code"><![CDATA[
        link $hhm_ffdata hhdb_hhm.ffdata &&
        link $hhm_ffindex hhdb_hhm.ffindex &&
        link $cs219_ffdata hhdb_cs219.ffdata &&
        link $cs219_ffindex hhdb_cs219.ffindex &&
        hhblits -n $n -e $e -i $input -d hhdb -o $output
    ]]></command>
    <inputs>
        <param format="data" name="input" type="data" label="Query Sequence" help="Single sequence or multiple sequence alignment (MSA)
                in a3m, a2m, or FASTA format, or HMM in hhm format (-i)"/>
        <param format="data" name="hhm_ffindex" type="data" label="HHM Index file" help="Database file ending with 'hhm.ffindex'"/>
        <param format="data" name="hhm_ffdata" type="data" label="HHM Data file" help="Database file ending with 'hhm.ffdata'"/>
        <param format="data" name="cs219_ffindex" type="data" label="cs219 Index file" help="Database file ending with 'cs219.ffindex'"/>
        <param format="data" name="cs219_ffdata" type="data" label="cs219 Data file" help="Database file ending with 'cs219.ffdata'"/>
        <param name="n" type="integer" label="Number of Iterations (-n)" value="2" min="1" max="8"/>
        <param name="e" type="float" label="E-value cutoff for inclusion in result alignment (-e)" value="0.001" min="0" max="1"/>
    </inputs>
    <outputs>
        <data format="data" name="output" />
    </outputs>
    <tests>
        <test>
            <param name="input" value="6VYB_A.fasta"/>
            <param name="hhm_ffindex" value="dbCAN-fam-V8/dbCAN-fam-V8_hhm.ffindex"/>
            <param name="hhm_ffdata" value="dbCAN-fam-V8/dbCAN-fam-V8_hhm.ffdata"/>
            <param name="cs219_ffindex" value="dbCAN-fam-V8/dbCAN-fam-V8_cs219.ffindex"/>
            <param name="cs219_ffdata" value="dbCAN-fam-V8/dbCAN-fam-V8_cs219.ffdata"/>
            <output name="output" file="6VYB_A.hhr" lines_diff="4"/>
        </test>
    </tests>
    <help><![CDATA[
HMM-HMM-based lightning-fast iterative sequence search
HHblits is a sensitive, general-purpose, iterative sequence search tool that represents
both query and database sequences by HMMs. You can search HHblits databases starting
with a single query sequence, a multiple sequence alignment (MSA), or an HMM. HHblits
prints out a ranked list of database HMMs/MSAs and can also generate an MSA by merging
the significant database HMMs/MSAs onto the query MSA.

Download databases from: http://wwwuser.gwdg.de/~compbiol/data/hhsuite/databases/hhsuite_dbs/
    ]]></help>
    <citations>
        <citation type="bibtex">
@misc{githubhh-suite,
  author = {Soeding, Johannes},
  year = {2005},
  title = {Protein homology detection by HMM-HMM comparison},
  publisher = {Oxford University Press},
  journal = {Bioinformatics},
  url = {https://doi.org/10.1093/bioinformatics/bti125},
}</citation>
    </citations>
</tool>