Mercurial > repos > recetox > suite_qcxms

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planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/qcxms commit 934037d9bacdb22293792c3d7bca9d2d34b65af9
author recetox
date Tue, 16 Apr 2024 11:31:24 +0000
parents 9c0e8156d804
children e28eb547b972
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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_getres" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="ef51824f6d04"/>
    <repository owner="recetox" name="qcxms_neutral_run" toolshed="https://toolshed.g2.bx.psu.edu" changeset_revision="6c118de4b735"/>
</repositories>