Mercurial > repos > bgruening > ctb_rdkit_descriptors

view test-data/mols.smi @ 6:d68bf44e1f5c draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdkit commit a03b1b7b283901a1510562f1e6eba41f70afaac4"
author bgruening
date Mon, 23 Mar 2020 15:58:09 -0400
parents 414edd9ea77d
children
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NCCCCC(N)C(=O)O	lysine
O=C(O)C(N)C	alanine
N[C@@H](CC1=CC=CC=C1)C(O)=O	phenylanaline