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Or is there an option to trigger it? Thanks, F.
The text was updated successfully, but these errors were encountered:
It is in there: https://github.com/flatkinson/standardiser
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would be nice if the two projects join force, so that the community has access to a killer tool
This should be possible with the FragmentRemover class, possibly combined with the Uncharger. There is a configurable list of SMARTS patterns for what is removed.
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Or is there an option to trigger it?
Thanks,
F.
The text was updated successfully, but these errors were encountered: