Closed AndreaVolkamer closed 1 year ago
Remove datamol dependency and use rdkit functionality directly instead. This addresses issue https://github.com/volkamerlab/teachopencadd/issues/339.
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There is some json formatting error in the notebook. I will try to find it.
Description
Remove datamol dependency and use rdkit functionality directly instead. This addresses issue https://github.com/volkamerlab/teachopencadd/issues/339.
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