galaxycomputationalchemistry / galaxy-tools-compchem

:mega: Galaxy Tools for Computational Chemistry
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Workaround to output xvg file from gromacs sim tool #124

Closed KyllenD closed 3 years ago

KyllenD commented 3 years ago

Temporary fix until xvg collection can be created. Additional output created (output 8) to output outp.xvg (filename as set by -deffnm)