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Import NMR data from vendor files

Open deepanshs opened this issue 3 years ago • 5 comments

Import NMR data from vendor saved files.

  • [X] Bruker (raw)
  • [ ] Bruker (processed data)
  • [x] Tecmag
  • [ ] JEOL

Possibly use nmrglue to import the data and then convert the data to a CSDM object using csdmpy.

Example for converting NumPy data to CSDM object.

deepanshs avatar May 12 '21 12:05 deepanshs

@mccarthy677 Is this issue relevant now that the nmrglue is the link between the vendor files and mrsimulator?

deepanshs avatar Jul 03 '22 18:07 deepanshs

JEOL isn't covered by nmrglue, but Bruker and Tecmag can now be loaded into mrsimulator

mccarthy677 avatar Jul 14 '22 19:07 mccarthy677

If I recall, nmrglue can read the Bruker processed data. Is the processed data also converted to CSDM objects?

deepanshs avatar Jul 14 '22 21:07 deepanshs

Mentioning duplicate #200 issue and closing the duplicate.

deepanshs avatar Jul 14 '22 21:07 deepanshs

@deepanshs @pjgrandinetti If I recall, JOEL now supports CSDM export. Two related questions:

  1. Is this issue still relevant?
  2. Should a new issue be opened for adding import examples to the documentation?

I understand mrsimulator itself does not perform the imports, but users may find it helpful to have references grouped together.

mgiammar avatar Jun 05 '23 13:06 mgiammar