Mercurial > repos > recetox > msmetaenhancer

view test-data/msme_sample.tsv @ 15:560053b805d2 draft default tip

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planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/msmetaenhancer commit a57d984a9850c1faa44b6948981eb1303881ba9c
author recetox
date Thu, 14 Aug 2025 12:44:57 +0000
parents 646ef66527da
children
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comment	compound_name	id	num_peaks	casno	formula	mw
NIST MS# 245692, Seq# M1	Hydrogen	1	2	1333740	H2	2
NIST MS# 61316, Seq# M2	Deuterium	2	2	7782390	D2	4
Any=100 ; NIST MS# 61313, Seq# M64	Methane	3	6	74828	CH4	16
Any=100 ; NIST MS# 18807, Seq# R26	Methane	4	6	74828	CH4	16
Any=100 ; NIST MS# 18809, Seq# R27	Methane	5	6	74828	CH4	16
Any=100 ; NIST MS# 423924, Seq# R28	Methane	6	6	74828	CH4	16