Mercurial > repos > recetox > suite_qcxms

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planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/qcxms commit b757d35278216a1f43bd53ea687a951b005e47df
author recetox
date Wed, 20 Mar 2024 12:29:00 +0000
parents 342d44862d58
children 99ef33c420c2
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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_production_run" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="b566b27247f7"/>
    <repository owner="recetox" name="qcxms_neutral_run" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="0d9d72ef658f"/>
    <repository owner="recetox" name="qcxms_getres" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="ef51824f6d04"/>
</repositories>