├── .gitignore ├── ED-ESI plot.py ├── LICENSE ├── Polycondensation calculator.py ├── PyRSIR.py ├── README.md ├── common_losses.py ├── docs ├── molecule_readme.md └── mzml_psims_readme.md ├── isotope pattern overlay.py ├── msms interpreter assistant.py ├── nmols calculator.py ├── plot_excel_file.py ├── pythoms ├── __init__.py ├── colour.py ├── common_losses.py ├── mass_abbreviations.py ├── mass_dictionaries.py ├── molecule.py ├── mzml.py ├── progress.py ├── psims.py ├── scripttime.py ├── spectrum.py ├── tome.py └── xlsx.py ├── setup.py ├── spectrum binner.py ├── tests.py ├── user_mass_abbreviations.py ├── uv-vis plotter.py ├── validation_files ├── LY-2015-09-15 06 pyrsir example.xlsx ├── LY-2015-09-15 06.mzML.gz ├── MultiTest.mzML.gz ├── multitest_pyrsir_validation.xlsx └── xlsx_validation.xlsx ├── video frame renderer.py └── y-axis zoom figure.py /.gitignore: -------------------------------------------------------------------------------- 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