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bow tie

Determine the bow tie structure by calculating pathways between metabolites using a flux balance analysis (FBA) based approach.

About

The pipeline was written and tested with Python 3.8. The core libraries essential for the pipeline including: Cobra, Pandas, networkx, and related packages.

Installation

  1. create bow_tie environment using conda:
$ conda create -n bow_tie python=3.8
  1. install related packages using pip:
$ conda activate bow_tie
$ pip install cobra
$ pip install networkx
$ pip install openpyxl
$ pip install xlrd
$ pip install ipykernel
$ python -m ipykernel install --user --name bow_tie --display-name "bow_tie"

Steps to reproduce the analysis in the publication

Download all data and analysis code from github (directlt download or use git clone).

$ cd /file path/project save path/
$ git clone https://github.com/tibbdc/bow-tie.git

All results can be reproduced by executing the Jupyter Python notebooks:

  • bowtie_path.ipynb

    • the main script of determining the bow tie structure by FBA-based approach.
  • bowtie_graph.ipynb

    • the script for determining the bow tie structure by graph

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bow tie structure analysis

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