Mercurial > repos > recetox > suite_qcxms

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planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/qcxms commit 5a088c3d758c9a1dbd119dad55ecffa173139a40
author recetox
date Thu, 17 Oct 2024 06:17:50 +0000
parents 96ebc72d1111
children 5e2d49439b14
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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_getres" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="89b026d67e9f"/>
    <repository owner="recetox" name="qcxms_production_run" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="356f7916ac07"/>
    <repository owner="recetox" name="qcxms_neutral_run" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="33b7a99b6de3"/>
</repositories>