comparison tools/attributes/SbmlToMetaboliteTable/test-data/tests.tsv @ 0:3cdcfdae8bd2 draft default tip

"planemo upload for repository https://forgemia.inra.fr/metexplore/met4j-galaxy commit a58b6f8a6dde6ef64da64ee50395dc5bc848167a-dirty"
author lcottret
date Tue, 31 May 2022 07:45:16 +0000
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-1:000000000000 0:3cdcfdae8bd2
1 id name formula charge smiles inchi
2 A A null 0 null null
3 B B null 0 null null
4 A_ext A_ext null 0 C[C@@H](C(=O)O)NC 1S/C2H6O/c1-2-3/h3H,2H2,1H3
5 C C null 0 null null
6 D D null 0 null null
7 E E null 0 null null
8 D_ext D_ext null 0 null null
9 E_ext E_ext null 0 null null