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Reproducing MatBench results #6

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newalexander opened this issue Dec 11, 2023 · 2 comments
Open

Reproducing MatBench results #6

newalexander opened this issue Dec 11, 2023 · 2 comments

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@newalexander
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Hello, and thank you for making this work available! If I want to reproduce your results on the MatBench dataset (e.g., the log10 G result for DimeNet++), can you point me to what script I should run?

Compared to something like the QM9 script, I assume I'd want to use the dataloader functionality here and dataset here. Are there any other important changes from the QM9 script to keep in mind?
@chao1224
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Hi @newalexander,

Thank you for asking! I will release the codes and checkpoints for sure. Just this week, I'm at NeurIPS, so maybe I'm only able to provide you the clean scripts next week.

chao1224 added a commit that referenced this issue Jan 6, 2024
@chao1224
Draft for running material scripts, #6, #6, #6, #6, #6, #6
e3252c4
chao1224 added a commit that referenced this issue Jan 6, 2024
@chao1224
Draft for running material scripts, #6
ef102c4
@chao1224
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chao1224 commented Jan 6, 2024

Hi @newalexander,

Sorry for the delay. I just updated the draft scripts to the checkpoints branch for your reference.
I am working on cleaning-up the scripts and checkpoints. Please stay tuned.

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@chao1224 @newalexander