Mercurial > repos > bgruening > enumerate_charges
view test-data/mols.smi @ 1:3d96dc99698f draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdkit commit 09b22cceacb34dd4c6c1b42890f93232df128208"
author | bgruening |
---|---|
date | Sat, 21 Mar 2020 14:03:09 -0400 |
parents | 0f3e5c69251e |
children |
line wrap: on
line source
NCCCCC(N)C(=O)O lysine O=C(O)C(N)C alanine N[C@@H](CC1=CC=CC=C1)C(O)=O phenylanaline