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A problem realted to t000_ss2. #106

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Luckken21 opened this issue May 13, 2024 · 4 comments
Open

A problem realted to t000_ss2. #106

Luckken21 opened this issue May 13, 2024 · 4 comments

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@Luckken21
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(RFAA1) [2200012187@hr-6-6-login RoseTTAFold-All-Atom]$ python -m rf2aa.run_inference --config-name protein
/gpfs/share/home/2200012187/mambaforge/envs/RFAA1/lib/python3.10/site-packages/hydra/_internal/defaults_list.py:251: UserWarning: In 'protein': Defaults list is missing _self_. See https://hydra.cc/docs/1.2/upgrades/1.0_to_1.1/default_composition_order for more information
warnings.warn(msg, UserWarning)
Using the cif atom ordering for TRP.
./make_msa.sh examples/protein/7u7w_A.fasta 7u7w_protein/A 4 64 pdb100_2021Mar03/pdb100_2021Mar03
Predicting: 100%|???????????????????????????????????????????????????????????????????????????????????| 1/1 [00:00<00:00, 1.58sequences/s]
Running HHblits against UniRef30 with E-value cutoff 1e-10

  • 07:49:51.566 INFO: Input file = 7u7w_protein/A/hhblits/t000_.1e-10.a3m

  • 07:49:51.566 INFO: Output file = 7u7w_protein/A/hhblits/t000_.1e-10.id90cov75.a3m

  • 07:49:51.746 WARNING: Maximum number 100000 of sequences exceeded in file 7u7w_protein/A/hhblits/t000_.1e-10.a3m

  • 07:50:30.457 INFO: Input file = 7u7w_protein/A/hhblits/t000_.1e-10.a3m

  • 07:50:30.457 INFO: Output file = 7u7w_protein/A/hhblits/t000_.1e-10.id90cov50.a3m

  • 07:50:30.638 WARNING: Maximum number 100000 of sequences exceeded in file 7u7w_protein/A/hhblits/t000_.1e-10.a3m

Running PSIPRED
Running hhsearch
cat: 7u7w_protein/A/t000_.ss2: No such file or directory
I try to run the 7u7w_protein, but why the programm cannot find t000_.ss2? Thanks a lot if you can help me!

@caicaiandfeifei
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I met the same problem, and felt confused.I'm trying to reinstall PSIPRED, but it doesn't really work

@dirrei
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dirrei commented May 15, 2024

I had the same issue and for me 'input_prep/make_ss.sh' was not set as executable. This could be fixed with a simple: chmod 755 input_prep/make_ss.sh
Hope that helps.

@Luckken21
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I have solved the problem by using dirrei's method. Thanks a lot!

@Yang-Wang-2020
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Yang-Wang-2020 commented Jun 6, 2024

Same here. The psipred issue was solved using dirrei's method. Thanks a lot!

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4 participants