Removes coordination complexes compounds #441
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hechth
requested changes
Nov 22, 2023
Co-authored-by: Helge Hecht <[email protected]>
…axytools into wverastegui/issue430
hechth
reviewed
Nov 27, 2023
hechth
approved these changes
Nov 27, 2023
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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: #430