Comments (4)
The downloads currently include no precomputed alignments---those you'll need to generate yourself. We do provide scripts for downloading the required databases and also a simple script that runs the actual alignment (instructions for which are provided in the README). Let me know if you have any further questions.
(We do plan to release a large dataset of AlphaFold training MSAs soon, however. Stay tuned)
from openfold.
The downloads currently include no precomputed alignments---those you'll need to generate yourself. We do provide scripts for downloading the required databases and also a simple script that runs the actual alignment (instructions for which are provided in the README). Let me know if you have any further questions.
(We do plan to release a large dataset of AlphaFold training MSAs soon, however. Stay tuned)
Yeah, I intend to generate alignments by runing "precompute_alignments.py", but I need to input the path "mmcif_dir/" as a parameter in precompute_alignments.py, then I cannot find the path "mmcif_dir", so I don't know which proteins need to be aligned before training the model.
from openfold.
input_dir
is just a directory containing target files you want to run the alignment tools on. It can contain .cif mmCIF files, FASTA files, or ProteinNet .core files. If you want to use the same data as AlphaFold and have downloaded pdb_mmcif
, then the value of input_dir
would be <path_to_dir>/pdb_mmcif/mmcif_files
.
from openfold.
get it! Thanks for your reply.
from openfold.
Related Issues (20)
- Inference error using precomputed alignments
- Pickling error in Docker? HOT 1
- Is the pdb_mmcif.zip from OpenProteinSet on AWS suitable for RODA training data? HOT 1
- Finetune from AF_Multimer parameters HOT 5
- Unable to create conda environment HOT 5
- I notice there is only instructions for a Linux Install, can I run this on my Windows laptop? HOT 1
- Frequently failed in training. HOT 2
- Rigid.from_3_points comment HOT 1
- Colab broken by version skew HOT 1
- Docker build broken HOT 4
- Question: Can the geometry module and rigid_utils be converted to each other?
- Alignment error during inference HOT 1
- ModuleNotFoundError: No module named 'attn_core_inplace_cuda' HOT 3
- Enable Dropout in inference HOT 1
- Questions about the meaning of folder naming conventions in OpenProteinSet HOT 1
- ModuleNotFoundError: No module named 'attn_core_inplace_cuda' HOT 1
- RuntimeError: Error building extension 'evoformer_attn' HOT 1
- Multimer predicting a homomer HOT 2
- Docker container AttributeError: Did you mean: 'linear_a_p'? when trying to run multimer inference
- Unable to install OpenFold in Google Colaboratory
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