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2 | 2 |
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3 | 3 | BioAlign is a user-friendly tool for DNA sequence alignment and visualization. It uses Clustal Omega for alignment and creates nicely formatted Word documents with customizable sequence highlighting. |
4 | 4 |
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| 5 | +## Table of Contents |
| 6 | +- [Features](#features) |
| 7 | +- [Installation](#installation) |
| 8 | +- [Usage](#usage) |
| 9 | + - [Preparing Your Sequences](#preparing-your-sequences) |
| 10 | + - [Running the Application](#running-the-application) |
| 11 | + - [Search Options](#search-options) |
| 12 | + - [Output](#output) |
| 13 | +- [Example](#example) |
| 14 | +- [Notes](#notes) |
| 15 | +- [Developer Setup](#developer-setup) |
| 16 | + - [Installing Python Dependencies](#installing-python-dependencies) |
| 17 | + - [Installing Clustal Omega](#installing-clustal-omega) |
| 18 | + - [Required Files Structure](#required-files-structure) |
| 19 | +- [Requirements](#requirements) |
| 20 | +- [Troubleshooting](#troubleshooting) |
| 21 | +- [Contributing](#contributing) |
| 22 | +- [License](#license) |
| 23 | +- [Acknowledgements](#acknowledgements) |
| 24 | + |
5 | 25 | ## Features |
6 | 26 |
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7 | 27 | - Automatic DNA sequence alignment using Clustal Omega |
@@ -77,9 +97,87 @@ For the provided example sequences, searching for "CTG" with spaced mode enabled |
77 | 97 | - The Word document uses Courier New font for consistent spacing |
78 | 98 | - Highlighting uses yellow by default, or green/blue/pink when using separate colors |
79 | 99 |
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| 100 | +## Developer Setup |
| 101 | + |
| 102 | +If you only want to work with the source code (main.py), you'll need to set up the following dependencies: |
| 103 | + |
| 104 | +### Installing Python Dependencies |
| 105 | + |
| 106 | +```bash |
| 107 | +pip install biopython python-docx |
| 108 | +``` |
| 109 | + |
| 110 | +### Installing Clustal Omega |
| 111 | + |
| 112 | +1. **Windows**: |
| 113 | + - Download Clustal Omega from http://www.clustal.org/omega/ |
| 114 | + - Extract the files to a directory named `clustal-omega-1.2.2-win64` in the same folder as main.py |
| 115 | + - Ensure that `clustalo.exe` is directly inside this directory |
| 116 | + |
| 117 | +2. **macOS**: |
| 118 | + - Install via Homebrew: `brew install clustal-omega` |
| 119 | + - Modify the path in the prepare_seq function where Clustal Omega is called to use: `command_return = subprocess.run(f"clustalo --infile {input_file_name} --outfile {output_file_name} --outfmt clustal --force", shell=True)` |
| 120 | + |
| 121 | +3. **Linux**: |
| 122 | + - Install via package manager: `sudo apt install clustal-omega` (Ubuntu/Debian) or equivalent |
| 123 | + - Modify the path in the prepare_seq function where Clustal Omega is called to use: `command_return = subprocess.run(f"clustalo --infile {input_file_name} --outfile {output_file_name} --outfmt clustal --force", shell=True)` |
| 124 | + |
| 125 | +### Required Files Structure |
| 126 | + |
| 127 | +Create the following files in your working directory: |
| 128 | +- `main.py` - The main program |
| 129 | +- `sequences.json` - Your DNA sequences in JSON format |
| 130 | +- `start.bat` (optional) - For easy launching on Windows |
| 131 | + |
80 | 132 | ## Requirements |
81 | 133 |
|
82 | | -This package is self-contained and works on Windows systems without additional installations. |
| 134 | +For end users, the release package is self-contained and works on Windows systems without additional installations. |
| 135 | + |
| 136 | +For developers working with just the source code: |
| 137 | +- Python 3.6 or higher |
| 138 | +- Biopython library |
| 139 | +- python-docx library |
| 140 | +- Clustal Omega (installed as described above) |
| 141 | +- Access to write files in the working directory |
| 142 | + |
| 143 | +## Troubleshooting |
| 144 | + |
| 145 | +### Common Issues |
| 146 | + |
| 147 | +1. **"No module named 'Bio'"** |
| 148 | + - Make sure you've installed Biopython: `pip install biopython` |
| 149 | + |
| 150 | +2. **"No module named 'docx'"** |
| 151 | + - Make sure you've installed python-docx: `pip install python-docx` |
| 152 | + |
| 153 | +3. **"An error occurred while running clustal-omega"** |
| 154 | + - Verify that Clustal Omega is installed correctly in the expected location |
| 155 | + - Check that you have executable permissions for the Clustal Omega binary |
| 156 | + - Try running Clustal Omega manually to verify it works outside the application |
| 157 | + |
| 158 | +4. **"ModuleNotFoundError: No module named 'sequences'"** |
| 159 | + - Ensure that `sequences.json` exists in the same directory as main.py |
| 160 | + - Check that the JSON file is properly formatted |
| 161 | + |
| 162 | +5. **Word document has no highlighting** |
| 163 | + - Make sure you entered a valid sequence pattern that exists in your DNA sequences |
| 164 | + - Verify you selected the appropriate search mode for your pattern |
| 165 | + |
| 166 | +## Contributing |
| 167 | + |
| 168 | +Contributions to improve BioAlign are welcome! Here's how you can contribute: |
| 169 | + |
| 170 | +1. Fork the repository |
| 171 | +2. Create a feature branch: `git checkout -b new-feature` |
| 172 | +3. Make your changes |
| 173 | +4. Test your changes thoroughly |
| 174 | +5. Submit a pull request with a clear description of the improvements |
| 175 | + |
| 176 | +Please ensure your code maintains compatibility with the existing functionality and follows the project's coding style. |
| 177 | + |
| 178 | +## License |
| 179 | + |
| 180 | +This project is licensed under the GNU General Public License v3.0 - see the LICENSE file for details. |
83 | 181 |
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84 | 182 | ## Acknowledgements |
85 | 183 |
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