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abhshkdz avatar abhshkdz commented on July 30, 2024 1

Here are predictions on val and test for the schnet_all_large model released here:

val: https://drive.google.com/file/d/1_xM4uZQEsJ-0UpIvocFM-rD1RRoiBtnc/view?usp=sharing
test: https://drive.google.com/file/d/1xG1gn0wDquTYNkI1ZOQ3X3Tw82rWgFAE/view?usp=sharing

You can unzip and read these as preds = np.load(filename, allow_pickle=True).

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abhshkdz avatar abhshkdz commented on July 30, 2024

Thanks for reaching out! Yeah, we can share predictions on val / test for our S2EF SchNet model. I'll get back to you with those in a day or so.

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LarsSchaaf avatar LarsSchaaf commented on July 30, 2024

Thank you for making this available so quickly!

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