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RoseTTAFold.ipynb crashes at "Install and import libraries" step in the google colab

Open shafayetrahat opened this issue 11 months ago • 2 comments

Expected Behavior

RoseTTAFold.ipynb should install the dependencies and predict the protein structure

Current Behavior

RoseTTAFold.ipynb crashes at "Install and import libraries" step in google colab

Steps to Reproduce (for bugs)

After running the RoseTTAFold.ipynb in google colab you will see this error directly

ColabFold Output (for bugs)

image

Context

Possible reason is upgrade of google colab cuda driver from cuda 11 to cuda 12. " %shell pip install -q dgl-cu113 -f https://data.dgl.ai/wheels/repo.html" This line can be the origin of the problem. Probably, need to change the dgl library and pytorch library to cuda12. Also, may need to change the rosettafold function accordingly.

shafayetrahat avatar Mar 17 '24 16:03 shafayetrahat