HeliXonProtein / binding-ddg-predictor

open source repository
Apache License 2.0
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Issue with running ddg-predictor #4

Open chen-khoo opened 2 years ago

chen-khoo commented 2 years ago

Hi, I followed the instructions and installed the package. However, it seemed to be in an endless loop when I ran the example WT and mutant pdb provided. After troubleshooting, I narrowed down my problem to cudatoolkit might not be compatible with my GPU. I wanted to ask if there is a GPU requirement to run your ddg-predictor?