molass-gui
Tkinter GUI for Molass — progressive SEC-SAXS analysis workflow.
Five-phase workflow
| Phase | Window | What happens |
|---|---|---|
| 1 Setup | Main window | Enter the data folder path |
| 2 Naive View | plot_compact with baseline |
Inspect raw data; enter number of components; click Decompose |
| 3 Quick Optimization View | plot_components (EGH) |
Review EGH decomposition; select column model; click Upgrade or Skip |
| 4 Upgraded View | plot_components (column model) |
Review upgraded decomposition; select method (BH/DE) and subprocess option; click Rigorous Optimization… |
| 5 Rigorous Optimization View | 4-panel live monitor | Rg curve computed → initial score drawn → optimization starts automatically; Terminate button available |
Installation
pip install molass-gui
Usage
molass-gui
Or during development (from the repository root):
py app.py
Requirements
- Python 3.9–3.14
- molass ≥ 1.0.7
- molass_legacy ≥ 1.6.15
1 maintainer
Release files for molass-gui 0.4.1
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | |
|---|---|---|---|
| molass_gui-0.4.1.tar.gz | 47.5 kB | Details |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Reset |
|---|---|---|---|---|
| molass_gui-0.4.1-py3-none-any.whl | Python 3 | none | any | Details |
Total release size: 99.1 kB
Release files / molass_gui-0.4.1.tar.gz
| Download URL | molass_gui-0.4.1.tar.gz |
|---|---|
| Size | 47.5 kB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
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Transparency logRelease files / molass_gui-0.4.1-py3-none-any.whl
| Download URL | molass_gui-0.4.1-py3-none-any.whl |
|---|---|
| Size | 51.6 kB |
| Tags | Python 3 |
|
SHA-256 checksum How to use checksums |
14e2ed24a1e158dda00ed2b3fc5d15b554881cf9a5d047b1c23151acd44f8cb0
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| Upload date | |
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Uploaded using Trusted Publishing? What is trusted publishing? |
Yes |
| Uploaded via |
twine/7.0.0 CPython/3.13.14
|
Provenance
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PyPI Publish Attestation
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