Mercurial > repos > recetox > matchms_split

view test-data/remove_spectra/require_retention_time.msp @ 24:7676700d7c4f draft default tip

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planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/matchms commit a57d984a9850c1faa44b6948981eb1303881ba9c
author recetox
date Thu, 14 Aug 2025 12:36:55 +0000
parents 6864944b00fd
children
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COMPOUND_NAME: C001
IONMODE: negative
SPECTRUMTYPE: Centroid
RETENTION_TIME: 38.74
RETENTION_INDEX: None
NUM PEAKS: 16
138.9121	10186226.0
175.0641	26780143.0
196.8658	21390430.0
198.8647	21688594.0
206.9034	26130980.0
254.8252	23747536.0
258.8237	15532799.0
266.8652	9805546.0
312.7841	10051801.0
316.7777	10734168.0
372.7383	19374863.0
382.8218	12815572.0
392.7685	10913351.0
434.7287	9943329.0
440.7322	10603010.0
488.6825	12267966.0