Mass Decomposer is a simple Python GUI application for decomposing a given mass (m/z) into amino acid combinations using the pyOpenMS library.
- Enter a mass and tolerance value.
- Possible amino acid combinations are displayed in a text box.
- Input validation and error messages.
- Python 3.x
- pyOpenMS
- Tkinter (usually included with Python)
-
Install dependencies:
pip install pyopenms -
Run the program:
python mass_decompose.pyw -
Enter the mass and tolerance, then click "OK" or press Enter to see results.
This project is for educational purposes only. Use with care and verify all outputs.