RECETOX / RIAssigner

RIAssigner is a python tool for retention index (RI) computation for GC-MS data.
MIT License
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Updated matchms dependency and removed test cases with `None` retention times #90

Closed hechth closed 2 years ago

hechth commented 2 years ago

I updated the dependency of matchms to >= 0.14.0 which includes the metadata harmonization module. The test cases having None or invalid values (such as -1) retention times are removed as they cause an error - I think this is desired behaviour as it is non-usable data at the moment.

This could be addressed in further work.

Close #89