8000 matchms: add wrapper for matchMS networking subpackage by maximskorik · Pull Request #286 · RECETOX/galaxytools · GitHub
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matchms: add wrapper for matchMS networking subpackage #286

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Merged
merged 70 commits into from
Oct 18, 2022
Merged

matchms: add wrapper for matchMS networking subpackage #286

merged 70 commits into from
Oct 18, 2022

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@maximskorik maximskorik commented Jul 15, 2022 •
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  • added matchMS networking tool to galaxytools
  • added test case for each possible output format
  • added maximskorik to the tool authors
  • tests are executed via checking the outputs with regular expressions due to inconsistent edges order in the output files

TODO:

Closes #257

@maximskorik maximskorik added the enhancement New feature or request label Jul 18, 2022
@maximskorik maximskorik changed the title add wrapper for matchMS networking subpackage matchms: add wrapper for matchMS networking subpackage Jul 19, 2022
@maximskorik maximskorik marked this pull request as ready for review October 13, 2022 17:32
maximskorik and others added 17 commits October 14, 2022 14:24
@maximskorik maximskorik mentioned this pull request Oct 17, 2022
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@maximskorik maximskorik merged commit f7bab98 into RECETOX:master Oct 18, 2022
@maximskorik maximskorik mentioned this pull request Oct 18, 2022
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@hechth hechth hechth approved these changes

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@maximskorik maximskorik

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enhancement New feature or request
Projects
Molecular Networking in Galaxy
Status: Done
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matchms: Implement networking wrapper
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@maximskorik @hechth
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