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…teinfold into updates
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JoseEspinosa committed Jun 10, 2024
2 parents 48a0a3f + f5bdad2 commit 0637765
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4 changes: 2 additions & 2 deletions .github/workflows/ci.yml
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Expand Up @@ -34,7 +34,7 @@ jobs:
- "test_colabfold_webserver"
- "test_colabfold_download"
- "test_esmfold"

steps:
- name: Check out pipeline code
uses: actions/checkout@0ad4b8fadaa221de15dcec353f45205ec38ea70b # v4
Expand All @@ -49,4 +49,4 @@ jobs:

- name: Run pipeline with test data ${{ matrix.parameters }} profile
run: |
nextflow run ${GITHUB_WORKSPACE} -profile ${{ matrix.parameters }},docker --outdir ./results_${{ matrix.parameters }}
nextflow run ${GITHUB_WORKSPACE} -profile ${{ matrix.parameters }},docker --outdir ./results_${{ matrix.parameters }}
3 changes: 1 addition & 2 deletions .nf-core.yml
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Expand Up @@ -2,6 +2,5 @@ repository_type: pipeline
nf_core_version: "2.14.1"
lint:
files_unchanged:
- .github/ISSUE_TEMPLATE/bug_report.yml
- pyproject.toml
- .github/CONTRIBUTING.md
multiqc_config: false
3 changes: 2 additions & 1 deletion README.md
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Expand Up @@ -55,7 +55,7 @@ nextflow run nf-core/proteinfold \
--outdir <OUTDIR>
```

The pipeline takes care of downloading the databases and parameters required by AlphaFold2, Colabfold or ESMFold. In case you have already downloaded the required files, you can skip this step by providing the path to the databases using the corresponding parameter [`--alphafold2_db`], [`--colabfold_db`] or [`--esmfold_db`]. Please refer to the [usage documentation](https://nf-co.re/proteinfold/usage) to check the directory structure you need to provide for each of the databases.
The pipeline takes care of downloading the databases and parameters required by AlphaFold2, Colabfold or ESMFold. In case you have already downloaded the required files, you can skip this step by providing the path to the databases using the corresponding parameter [`--alphafold2_db`], [`--colabfold_db`] or [`--esmfold_db`]. Please refer to the [usage documentation](https://nf-co.re/proteinfold/usage) to check the directory structure you need to provide for each of the databases.

- The typical command to run AlphaFold2 mode is shown below:

Expand Down Expand Up @@ -121,6 +121,7 @@ The pipeline takes care of downloading the databases and parameters required by
```

[!WARNING]

> If you aim to carry out a large amount of predictions using the colabfold_webserver mode, please setup and use your own custom MMSeqs2 API Server. You can find instructions [here](https://github.com/sokrypton/ColabFold/tree/main/MsaServer).

- The esmfold mode can be run using the command below:
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