#14775 closed defect (fixed)

AlphaFold not running (Invalid character in the sequence)

Reported by: MCINNES@… Owned by: Tom Goddard
Priority: normal Milestone:
Component: Structure Prediction Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

Please see below. AlphaFold has stopped working for some reason and I get the following:


2024-03-15 15:04:57,761 Starting prediction on 2024-03-15 UTC time
2024-03-15 15:04:57,762 Installing ColabFold on Google Colab virtual machine.
Using Tesla T4 graphics processor
2024-03-15 15:04:57,986 Running on GPU
2024-03-15 15:04:57,990 Found 5 citations for tools or databases
2024-03-15 15:04:57,990 Query 1/1: af42 (length 42)
COMPLETE: 100%|██████████| 150/150 [elapsed: 00:01 remaining: 00:00]
2024-03-15 15:04:59,631 Could not generate input features af42: Invalid character in the sequence:
Traceback (most recent call last):
  File "/usr/local/lib/python3.10/dist-packages/colabfold/batch.py", line 1512, in run
    = generate_input_feature(query_seqs_unique, query_seqs_cardinality, unpaired_msa, paired_msa,
  File "/usr/local/lib/python3.10/dist-packages/colabfold/batch.py", line 1039, in generate_input_feature
    feature_dict = build_monomer_feature(
  File "/usr/local/lib/python3.10/dist-packages/colabfold/batch.py", line 892, in build_monomer_feature
    **pipeline.make_sequence_features(
  File "/usr/local/lib/python3.10/dist-packages/alphafold/data/pipeline.py", line 40, in make_sequence_features
    features['aatype'] = residue_constants.sequence_to_onehot(
  File "/usr/local/lib/python3.10/dist-packages/alphafold/common/residue_constants.py", line 580, in sequence_to_onehot
    raise ValueError(f'Invalid character in the sequence: {aa_type}')
ValueError: Invalid character in the sequence:
2024-03-15 15:04:59,633 Done
Downloading structure predictions to directory Downloads/ChimeraX/AlphaFold
cp: cannot stat '*_relaxed_rank_001_*.pdb': No such file or directory

cp: cannot stat '*_scores_rank_001_*.json': No such file or directory






[Macintosh HD:Users:aerius:Downloads:FW__Pharmacy_logos:Pharmacy_Standard_202.eps]<http://www.sc.edu/pharmacy>
Campbell McInnes, Ph.D.
Professor, Medicinal Chemistry
Drug Discovery and Biomedical Sciences

University of South Carolina
College of Pharmacy
CLS 717A
715 Sumter Street
Columbia, South Carolina

803.576.5684 (o)
803.338.6340 (c)
mcinnes@cop.sc.edu<mailto:mcinnes@cop.sc.edu>
http://www.sc.edu/pharmacy



Added by email2trac

Attachments (1)

image001.png (4.8 KB ) - added by MCINNES@… 20 months ago.
Added by email2trac

Download all attachments as: .zip

Change History (4)

by MCINNES@…, 20 months ago

Attachment: image001.png added

Added by email2trac

comment:1 by Eric Pettersen, 20 months ago

Component: UnassignedStructure Prediction
Owner: set to Tom Goddard
Platform: all
Project: ChimeraX
Status: newassigned
Summary: AlphaFold not runningAlphaFold not running (Invalid character in the sequence)

Reported by Campbell McInnes

comment:2 by Tom Goddard, 19 months ago

ChimeraX Alphafold prediction is broken due to a change in Google Colab. I am not sure when it will get fixed, may be days or maybe in April when I am back from vacation. The problem is sending the sequence to Google Colab no longer works. I don't see any simple fix.

comment:3 by Tom Goddard, 19 months ago

Resolution: fixed
Status: assignedclosed

Fixed in the daily build.

More details in ticket #14777.

Note: See TracTickets for help on using tickets.