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dptech-corp / Uni-Dock

Uni-Dock: a GPU-accelerated molecular docking program
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Uni-Dock hangs forever on NVIDIA T4 GPU #67

Closed dp-yuanyn closed 8 months ago

dp-yuanyn commented 9 months ago

I tried to run Uni-Dock on NVIDIA T4 GPU, but it hanged forever: image failed_unidock.zip

Input files are attached and the command is in the run.sh file

caic99 commented 9 months ago

https://github.com/dptech-corp/Uni-Dock/pull/66 UT hangs since the runner uses a T4 GPU.

caic99 commented 9 months ago

We'll take a closer look on this issue. An workaround is provided at https://github.com/dptech-corp/Uni-Dock/pull/66/commits/9daba3f19fa3e40156d4b9b51b30fb5368112bb7

dp-yuanyn commented 8 months ago

fixed in v1.1