RECETOX / galaxytools

Set of Galaxy tool wrappers developed at RECETOX
MIT License
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Removes coordination complexes compounds #441

Closed wverastegui closed 10 months ago

wverastegui commented 10 months ago

The tool removes only coordination complexes compounds from a list of smiles. The input files can be csv, InChI and SMILEs formats. The tool return same input formats as output file formats.

Linked issue: https://github.com/RECETOX/galaxytools/issues/430