RobinPoelmans

RuntimeError for custom_evaluation.py

1

Hello, When I try to run custom_evaluation.py on the example custom pairs, I get the following error: Traceback (most recent call last): File "deeplytough/scripts/custom_evaluation.py", line 69, in main() File "deeplytough/scripts/custom_evaluation.py",...

Hi, When I try to run generate_ligands.py, I get the following error: **_Segmentation fault (core dumped)_** I am running on an NVIDIA RTX A4500 GPU, with 20470MiB VRAM, and I...