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Added reaction drawing support and svg size options for reactions #25

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merged 2 commits into from
Mar 30, 2023

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ipendlet
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A nice feature addition would be the ability to visualize reaction performance and see the content of an entire reaction. This is easily supported by rdkit. The relevant code and the flexibility around the svg specification was added.

@wjm41
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wjm41 commented Mar 23, 2023

Looks good to me! If you could include a short example notebook showing it in use, that would be great :)

@ipendlet
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@wjm41 I made the requested change and include a way to use the current version instead of the 'heatmap' in plotly which doesn't currently work due to the list-of-lists specification. This nicely gets around that, shows off the visualization, and is actually based on real data. Huzzah.

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wjm41 commented Mar 30, 2023

Great! Thanks so much :D

@wjm41 wjm41 closed this Mar 30, 2023
@wjm41 wjm41 reopened this Mar 30, 2023
@wjm41 wjm41 merged commit 680404a into wjm41:main Mar 30, 2023
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2 participants