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small changes #7
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cb-Hades committed Jul 17, 2024
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2 changes: 1 addition & 1 deletion README.md
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SPECIMEN is a collection of different workflows designed for the automated and standardised curation of genome-scale models. It is mainly based on the [refineGEMs toolbox](https://github.com/draeger-lab/refinegems/tree/dev-2), but also includes additional tools like [CarveMe](https://carveme.readthedocs.io/en/latest/).

> Note: This tool is currently still under active developement, any feedback or ides are welcome.
> Note: This tool is currently still under active developement, any feedback or ideas are welcome.
Currently avaible workflow:

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5 changes: 4 additions & 1 deletion docs/source/cmpb/run-pipeline.rst
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Expand Up @@ -57,7 +57,10 @@ from inside a Python script or Jupyter Notebook with "config.yaml" being the pat

The pipeline has two obligatory parameters:

- The path to the annotated genome file (if a model is given, should be the file used to create it)
- Path to a model

- If no model is given, the `protein_fasta` needs to be provided. The format needs to be the same as the files provides by NCBI under `<GenBank assembly>` -> `ftp` -> `<name>_translated_cds.faa.gz`

- A media configuration (from refineGEMs) for testing the model's growth

Further data can be added as available and/or needed (all are completely optional):
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1 change: 0 additions & 1 deletion pyproject.toml
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Expand Up @@ -49,7 +49,6 @@ docs = ["accessible-pygments",
"sphinx_copybutton",
"pip-tools"]

# @TODO:
[project.urls]
repository = 'https://github.com/draeger-lab/SPECIMEN'
documentation = 'https://specimen.readthedocs.io/en/latest/'
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3 changes: 2 additions & 1 deletion src/specimen/data/config/cmpb_config.yaml
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input:
modelpath: NULL # Optional, path to a model.
# If not given, runs CarveMe -> Future update!
annotated_genome: __USER__ # Required, path to the annotated genome file
# annotated_genome: USER # Some alternative input if not model is given
mediapath: __USER__ # Path to a media config to test growth with

# General options
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email: USER # User Mail to use for Entrez
protein_fasta: USER # Optional, except for 'is_lab_strain: True'.
# The path to the protein FASTA used to create the CarveMe model.
# For more information, please refer to the documentation.
is_lab_strain: False # Whether the users strain originates from a lab
# Needs to be set to ensure that protein IDs get the 'bqbiol:isHomologTo' qualifier
# & to set the locus_tag to the ones obtained by the annotation
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