view mol2_to_mol_converter.xml @ 0:85eca06eefc6 draft default tip

Uploaded
author bgruening
date Thu, 15 Aug 2013 03:19:26 -0400
parents
children
line wrap: on
line source

<tool id="CONVERTER_mol2_to_mol" name="MOL2 to MOL" version="1.0.0">
    <description></description>
    <parallelism method="multi" split_inputs="input" split_mode="to_size" split_size="10000" shared_inputs="" merge_outputs="output"></parallelism>
    <requirements>
        <requirement type="package" version="2.3.2">openbabel</requirement>
    </requirements>
    <command >obabel -imol2 "${input}" -omol -O "${output}" -e 2>&#38;1</command>
    <inputs>
        <param name="input" type="data" format="mol2" label="Molecules in MOL2-format"/>
    </inputs>
    <outputs>
        <data name="output" format="mol"/>
    </outputs>
    <help>
    </help>
</tool>