Mercurial > repos > recetox > suite_qcxms

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planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/qcxms commit 384b9f232ce56d35cc16cbf0e499c5e1be683933
author recetox
date Tue, 15 Apr 2025 12:33:32 +0000
parents 8a69e4cea9c6
children
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<?xml version="1.0" ?>
<repositories description="tools from QCxMS are used for molecular geometry optimization and in silico calculation of mass spectra using quantum chemistry">
    <repository owner="recetox" name="qcxms_neutral_run" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="475bbef634d4"/>
    <repository owner="recetox" name="qcxms_getres" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="0109f244d25a"/>
    <repository owner="recetox" name="qcxms_production_run" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="cbe34f060712"/>
</repositories>