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Add nmrglue extractor - #33

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ml-evs merged 6 commits into
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ml-evs/add-nmrglue
Jun 18, 2025
Merged

Add nmrglue extractor#33
ml-evs merged 6 commits into
mainfrom
ml-evs/add-nmrglue

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@ml-evs ml-evs commented May 20, 2025

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Adds an extractor for https://github.com/jjhelmus/nmrglue.

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ml-evs marked this pull request as ready for review June 17, 2025 09:55
Comment on lines +10 to +16
supported_filetypes:
- id: jcamp-dx
template:
input_type: jcampdx
description: >-
Note: Only 1D NMR data is supported, not the full JCAMP-DX standard. Many
other NMR data file formats are supported.

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Note: added in #32.

Comment on lines +36 to +38
- method: python
setup: nmrglue
command: nmrglue.fileio.{{ input_type }}.read

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Is yadg the only package that bothered with a command-line API?

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Imagine so, presumably because you embed some provenance and traceability in your output format, where most other codes don't

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ml-evs merged commit c201fad into main Jun 18, 2025
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2 participants