volkamerlab / teachopencadd

TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data
https://projects.volkamerlab.org/teachopencadd
Creative Commons Attribution 4.0 International
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T033: Remove talktorial datamol dependency #351

Closed AndreaVolkamer closed 1 year ago

AndreaVolkamer commented 1 year ago

Description

Remove datamol dependency and use rdkit functionality directly instead. This addresses issue https://github.com/volkamerlab/teachopencadd/issues/339.

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review-notebook-app[bot] commented 1 year ago

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mbackenkoehler commented 1 year ago

There is some json formatting error in the notebook. I will try to find it.