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hadim avatar hadim commented on August 16, 2024

Thanks for the feedbacks. This feature is quite new and so not fully mature yet!

Thanks for 1) and 2), those are indeed two implementation mistakes.

As for 3), it would be nice to see those two features indeed and we already thought about those but didn't get the time to implement them yet!

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hadim avatar hadim commented on August 16, 2024

This is fixed in #198

image

Thanks for reporting the bugs but also for digging into the code and debugging those issues. This is much appreciated!


It would be great to do lasso highlighting with a grid containing multiple images.

I won't be able to tackle that short term but will open an issue so we don't forget!

It would be helpful to have a function that would accept a list of lists of atom indices to be highlighted in addition to the existing function that takes SMILES.

In the same PR as above, you can now do:

image

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PatWalters avatar PatWalters commented on August 16, 2024

This is fantastic, thank you!

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hadim avatar hadim commented on August 16, 2024

For the record: #199

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