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Update MSME to new version #501

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hechth opened this issue Mar 11, 2024 · 0 comments · Fixed by #512

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hechth commented Mar 11, 2024 •

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The available options will need to be updated to include the inchikey -> inchi conversion and formula-> mw conversions

The new version has some additional converters and the list of all possible conversions can be generated using this script: https://github.com/RECETOX/MSMetaEnhancer/blob/main/galaxy/generate_options.py

zargham-ahmad self-assigned this

zargham-ahmad mentioned this issue

Updated MSMetaEnhancer to 0.4.0 #512

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hechth closed this as completed in #512

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