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Full routes dataset? #4

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najwalb opened this issue Dec 18, 2024 · 1 comment
Open

Full routes dataset? #4

najwalb opened this issue Dec 18, 2024 · 1 comment

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@najwalb
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najwalb commented Dec 18, 2024

Hello,

Great work! Do you happen to have the full routes for the test targets you're using (i.e. USPTO-190, and the 2 Pitachio)? The paper contains statistics about the test routes, but the data you shared here only gives the target and the goal starting material.

@najwalb
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najwalb commented Dec 18, 2024

Ok, I found links to the full routes of USPTO-190 in this issue in RetroStar's github repo. Here are the links for ease of reference: train, val, test.

I also made a pull request to retrostar to add the links to their readme. Do I understand correctly that you're using the same routes as RetroStar for USPTO-190? And any chance you can share the pistachio routes?

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