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GEOM data split indices needed

Open Atomu2014 opened this issue 10 months ago • 1 comments

Hi,

Can you provide the data indices for your original split of GEOM? I find some issues in the GEOM dataset and I need to re-process it. I want to keep the same data split as your paper.

Please help.

Thanks

Atomu2014 avatar Feb 19 '25 06:02 Atomu2014

I shared processed files for GEOM-DRUGS dataset here: https://huggingface.co/datasets/chaitjo/GEOM-DRUGS_ADiT

I did the processing based on the raw pickle files released as part of MiDi.

chaitjo avatar May 29 '25 19:05 chaitjo