Mercurial > repos > metexplore > met4j

view tools/attributes/GetMetaboliteAttributes/test-data/tests.tsv @ 10:6a112eaf8f38 draft

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planemo upload for repository https://forgemia.inra.fr/metexplore/met4j-galaxy commit 71071300dd662ad01bd064abcf6866a192eeea95
author metexplore
date Mon, 03 Feb 2025 15:59:46 +0000
parents 0976a6257300
children
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id	name	formula	charge	smiles	inchi
A	A	null	0	null	null
B	B	null	0	null	null
A_ext	A_ext	null	0	C[C@@H](C(=O)O)NC	1S/C2H6O/c1-2-3/h3H,2H2,1H3
C	C	null	0	null	null
D	D	null	0	null	null
E	E	null	0	null	null
D_ext	D_ext	null	0	null	null
E_ext	E_ext	null	0	null	null