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modify ff.py file and add pre-trained folder.#123

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dogs1231992 wants to merge 2 commits intousnistgov:mainfrom
dogs1231992:alignn_ff
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modify ff.py file and add pre-trained folder.#123
dogs1231992 wants to merge 2 commits intousnistgov:mainfrom
dogs1231992:alignn_ff

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modify ff.py file and add pre-trained folder.

modify ff.py file and add pre-trained folder.
@knc6
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knc6 commented Jul 10, 2023

I am thinking to upload these models to figshare soon. We can discuss during our meeting.

Integrate AlignnAtomwiseCalculator and AlignnCalculator
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knc6 commented Aug 11, 2023

Hi @dogs1231992

Thanks for the PR. It has some conflicts that needs to be taken care of before merging.

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dogs1231992 commented Aug 11, 2023 via email

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