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bjing2016 avatar bjing2016 commented on August 19, 2024

Can you check if the OpenFold version is correct? A previous version of the README had the wrong install command --- see #2 where the issue sounds similar to what you describe with the ExtraMSAStack.

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jfreeze95 avatar jfreeze95 commented on August 19, 2024

Yep, that was it. Thanks!
In case anyone asks, the git request for the commit from OpenFold you specify won't work if you have Cuda 12.3, which is what led me to try the latest OpenFold commit which did work with 12.3 before I got Cuda 11.6 setup.
Also, in mmseqs_query line 284 you have a hard-coded iloc[:3] which only allows the first three entries of a csv file to be processed. I ran into that when trying to use the atlas_test.csv file which will then throw an error during inference when it can't find the 4th entry's mmSeq folder.

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bjing2016 avatar bjing2016 commented on August 19, 2024

Thanks, mmseqs_query has been fixed.

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