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biocore / q2-qemistree

Hierarchical orderings for mass spectrometry data. Canonically pronounced "chemis-tree".
BSD 2-Clause "Simplified" License
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update classyfire API #133

Closed anupriyatripathi closed 4 years ago

anupriyatripathi commented 4 years ago

to hit the classyfire tool that assigns taxonomy to new structures as opposed to just looking in the cached structures: https://gnps-classyfire.ucsd.edu/entities/POYJMHOBPDUBGZ-UHFFFAOYSA-N.json?smiles=CC%28C%28C1%3DCC%3DCC%3DC1%29OC2C%28C%28C%28C%28CO%29O2%29O%29O%29O%29N