High-res peak overwriting with theoretical MS tool

RECETOX / galaxytools

Set of Galaxy tool wrappers developed at RECETOX

MIT License

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High-res peak overwriting with theoretical MS tool #487

Closed wverastegui closed 9 months ago

wverastegui commented 9 months ago

This PR overwrites theoretical M/Z annotations, supported MSP and MGF files. You can choose whether to include non-annotated peaks in the output. Includes test-data.

Closes https://github.com/RECETOX/galaxytools/issues/485

wverastegui commented 9 months ago

Accidentally committed this 0b196ad. How can it be discarded?.