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[TODO]: Add example notebook(s) for interoperability between chemprop and other libraries #804

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kevingreenman opened this issue Apr 17, 2024 · 0 comments
Open

[TODO]: Add example notebook(s) for interoperability between chemprop and other libraries #804

kevingreenman opened this issue Apr 17, 2024 · 0 comments
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@hwpang
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mlpds Issue/PR by MLPDS member (priority) todo add an item to the to-do list
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v2.1.0

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@kevingreenman
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At the MLPDS meeting, we got a question about how one could use chemprop featurizers with other packages (e.g. DGL or sklearn), such that they could use the same featurizer across all of their models. If possible, it would be nice to add an example notebook of this to highlight the modularity of v2.
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mlpds Issue/PR by MLPDS member (priority) todo add an item to the to-do list
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v2.1.0
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@kevingreenman @hwpang