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Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2

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Hi, Everything is in the title ^^ More specifically, I am wondering if there is a way to run openfold on a macbook pro M3 or if support for apple...

Right now openfold asks for old pytorch + cuda (11.2), thus latest linux is not able to build openfold. Would like to upgrade the supported pytorch + cuda and other...

Collecting openfold Using cached openfold-0.0.1.tar.gz (164 kB) error: subprocess-exited-with-error × python setup.py egg_info did not run successfully. │ exit code: 1 ╰─> See above for output. note: This error originates...

Hi, I wanted to express my excitement about the team's plans to release the training code for OpenFold-Multimer (press report [here](https://www.businesswire.com/news/home/20240219658831/en/OpenFold-Biotech-AI-Research-Consortium-releases-SoloSeq-and-Multimer-an-integrated-protein-Large-Language-Model-with-3D-structure-generation)). It's really fantastic to see such progress! I found...

I have a question regarding the number of recycling iterations used during training. In the AF2 paper they mention that the number of recycling iterations are a "shared value across...

Hello! Explain me please, how can I use` *.ckpt ` files after train OpenFold for the prediction by `run_pretrained_openfold.py`? Or perhaps I need to somehow convert this to another format...

I am trying to run inference using OpenFold and I found that finetining_ptm_2.pt was missing in openfold/resources/openfold_params. I found a similar file on [hugging faces ](https://huggingface.co/nz/OpenFold/blob/1c97ae6b3b5482adac17888bbf1d547f81f8a888/README.md) and used their file....

File "setup.py", line 130, in 'Programming Language :: Python :: 3.7,' File "/home/panjie/projects/tools/openfold/lib/conda/envs/openfold_venv/lib/python3.7/site-packages/setuptools/__init__.py", line 153, in setup return distutils.core.setup(**attrs) File "/home/panjie/projects/tools/openfold/lib/conda/envs/openfold_venv/lib/python3.7/distutils/core.py", line 148, in setup dist.run_commands() File "/home/panjie/projects/tools/openfold/lib/conda/envs/openfold_venv/lib/python3.7/distutils/dist.py", line 966,...

## Introduction & motiviation Dear OpenFold team, Thank you very much for creating such a useful tool and give the community the opportunity to use, ablate and extend the implementation!...

I downloaded the roda `pdb` subdir, with the following command ```bash aws s3 cp --no-sign-request 's3://openfold/pdb' ./pdb --recursive ``` Then, following the readme, I ran the `scripts/flatten_roda.sh` and it keep...