annotate test-data/log_smiles.smi @ 4:ae66b58846cd draft

planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/recetox_msfinder commit ad60bf881a8fd00546909c76d65ea3c6b65a4fe9
author recetox
date Fri, 01 Dec 2023 09:23:21 +0000
parents
children e7eff0c9baa3
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
4
ae66b58846cd planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/recetox_msfinder commit ad60bf881a8fd00546909c76d65ea3c6b65a4fe9
recetox
parents:
diff changeset
1 Cl[Si]1Oc2ccccc2O1.[C-]#[O+].[C-]#[O+].[CH]1C=CC=C1.[Fe]