pyFracAggregate 0.1.0__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- pyfracaggregate-0.1.0/.gitignore +169 -0
- pyfracaggregate-0.1.0/CLAUDE.md +58 -0
- pyfracaggregate-0.1.0/LICENSE +21 -0
- pyfracaggregate-0.1.0/PKG-INFO +24 -0
- pyfracaggregate-0.1.0/README.md +3 -0
- pyfracaggregate-0.1.0/examples/pyFracAggregate_demo.ipynb +434 -0
- pyfracaggregate-0.1.0/pyproject.toml +50 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/__init__.py +105 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/analysis/__init__.py +1 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/analysis/correlation.py +207 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/analysis/morphology.py +72 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/core/__init__.py +1 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/core/aggregate.py +93 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/core/distributions.py +62 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/core/math_utils.py +124 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/__init__.py +21 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/base.py +53 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/cca.py +95 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/factory.py +35 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/fracval.py +258 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/optimizer_flage.py +171 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/pca.py +46 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/placement/__init__.py +3 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/placement/_helpers.py +113 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/placement/algebraic.py +135 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/placement/base.py +81 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/placement/random_.py +46 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/generators/tdcca.py +251 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/io/__init__.py +1 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/io/data.py +57 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/io/visualization.py +123 -0
- pyfracaggregate-0.1.0/src/pyFracAggregate/io/vtk.py +28 -0
- pyfracaggregate-0.1.0/tests/test_analysis/test_correlation.py +45 -0
- pyfracaggregate-0.1.0/tests/test_analysis/test_morphology.py +60 -0
- pyfracaggregate-0.1.0/tests/test_core/test_aggregate.py +60 -0
- pyfracaggregate-0.1.0/tests/test_core/test_distributions.py +43 -0
- pyfracaggregate-0.1.0/tests/test_core/test_math_utils.py +89 -0
- pyfracaggregate-0.1.0/tests/test_density.py +31 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_benchmark.py +28 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_cca.py +47 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_cca_fracval.py +62 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_factory.py +31 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_optimizer_flage.py +98 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_pca.py +48 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_placement.py +193 -0
- pyfracaggregate-0.1.0/tests/test_generators/test_tdcca_thouy.py +34 -0
- pyfracaggregate-0.1.0/tests/test_io/test_data.py +84 -0
- pyfracaggregate-0.1.0/tests/test_io/test_visualization.py +50 -0
|
@@ -0,0 +1,169 @@
|
|
|
1
|
+
# Claude Code
|
|
2
|
+
.claude/worktrees/
|
|
3
|
+
docs/superpowers/
|
|
4
|
+
|
|
5
|
+
# Byte-compiled / optimized / DLL files
|
|
6
|
+
__pycache__/
|
|
7
|
+
*.py[cod]
|
|
8
|
+
*$py.class
|
|
9
|
+
|
|
10
|
+
# C extensions
|
|
11
|
+
*.so
|
|
12
|
+
|
|
13
|
+
# Distribution / packaging
|
|
14
|
+
bin/
|
|
15
|
+
build/
|
|
16
|
+
develop-eggs/
|
|
17
|
+
dist/
|
|
18
|
+
downloads/
|
|
19
|
+
eggs/
|
|
20
|
+
.eggs/
|
|
21
|
+
lib/
|
|
22
|
+
lib64/
|
|
23
|
+
parts/
|
|
24
|
+
sdist/
|
|
25
|
+
var/
|
|
26
|
+
wheels/
|
|
27
|
+
share/python-wheels/
|
|
28
|
+
*.egg-info/
|
|
29
|
+
.installed.cfg
|
|
30
|
+
*.egg
|
|
31
|
+
MANIFEST
|
|
32
|
+
|
|
33
|
+
# PyInstaller
|
|
34
|
+
# Usually these files are written by a python script from a template
|
|
35
|
+
# before PyInstaller builds the exe, so as to inject date/other infos into it.
|
|
36
|
+
*.manifest
|
|
37
|
+
*.spec
|
|
38
|
+
|
|
39
|
+
# Installer logs
|
|
40
|
+
pip-log.txt
|
|
41
|
+
pip-delete-this-directory.txt
|
|
42
|
+
|
|
43
|
+
# Unit test / coverage reports
|
|
44
|
+
htmlcov/
|
|
45
|
+
.tox/
|
|
46
|
+
.nox/
|
|
47
|
+
.coverage
|
|
48
|
+
.coverage.*
|
|
49
|
+
.cache
|
|
50
|
+
nosetests.xml
|
|
51
|
+
coverage.xml
|
|
52
|
+
*.cover
|
|
53
|
+
*.py,cover
|
|
54
|
+
.pytest_cache/
|
|
55
|
+
.hypothesis/
|
|
56
|
+
|
|
57
|
+
# Translations
|
|
58
|
+
*.mo
|
|
59
|
+
*.pot
|
|
60
|
+
|
|
61
|
+
# Django stuff:
|
|
62
|
+
*.log
|
|
63
|
+
local_settings.py
|
|
64
|
+
db.sqlite3
|
|
65
|
+
db.sqlite3-journal
|
|
66
|
+
|
|
67
|
+
# Flask stuff:
|
|
68
|
+
instance/
|
|
69
|
+
.webassets-cache
|
|
70
|
+
|
|
71
|
+
# Scrapy stuff:
|
|
72
|
+
.scrapy
|
|
73
|
+
|
|
74
|
+
# Sphinx documentation
|
|
75
|
+
docs/_build/
|
|
76
|
+
|
|
77
|
+
# PyBuilder
|
|
78
|
+
.pybuilder/
|
|
79
|
+
target/
|
|
80
|
+
|
|
81
|
+
# Jupyter Notebook
|
|
82
|
+
.ipynb_checkpoints
|
|
83
|
+
|
|
84
|
+
# IPython
|
|
85
|
+
profile_default/
|
|
86
|
+
ipython_config.py
|
|
87
|
+
|
|
88
|
+
# pyenv
|
|
89
|
+
# For a library or package, you might want to ignore these files since the Python version is
|
|
90
|
+
# usually managed by the user.
|
|
91
|
+
# .python-version
|
|
92
|
+
|
|
93
|
+
# pipenv
|
|
94
|
+
# According to pypa/pipenv#1181, it is recommended to include Pipfile.lock in version control.
|
|
95
|
+
# However, in case of collaboration, if having platform-specific dependencies or dependencies
|
|
96
|
+
# having no cross-platform support, pipenv may install dependencies that don't work, or even
|
|
97
|
+
# not install all dependencies needed on a specific platform.
|
|
98
|
+
# Pipfile.lock
|
|
99
|
+
|
|
100
|
+
# poetry
|
|
101
|
+
# Similar to Pipfile.lock, it is generally recommended to include poetry.lock in version control.
|
|
102
|
+
# poetry.lock
|
|
103
|
+
|
|
104
|
+
# pdm
|
|
105
|
+
# Similar to Pipfile.lock, it is generally recommended to include pdm.lock in version control.
|
|
106
|
+
# pdm.lock
|
|
107
|
+
|
|
108
|
+
# PEP 582; used by e.g. github.com/pdm-project/pdm
|
|
109
|
+
__pypackages__/
|
|
110
|
+
|
|
111
|
+
# Celery stuff
|
|
112
|
+
celerybeat-schedule
|
|
113
|
+
celerybeat.pid
|
|
114
|
+
|
|
115
|
+
# SageMath parsed files
|
|
116
|
+
*.sage.py
|
|
117
|
+
|
|
118
|
+
# Environments
|
|
119
|
+
.env
|
|
120
|
+
.venv
|
|
121
|
+
env/
|
|
122
|
+
venv/
|
|
123
|
+
ENV/
|
|
124
|
+
env.bak/
|
|
125
|
+
venv.bak/
|
|
126
|
+
|
|
127
|
+
# Spyder project settings
|
|
128
|
+
.spyderproject
|
|
129
|
+
.spyproject
|
|
130
|
+
|
|
131
|
+
# Rope project settings
|
|
132
|
+
.ropeproject
|
|
133
|
+
|
|
134
|
+
# mkdocs documentation
|
|
135
|
+
/site
|
|
136
|
+
|
|
137
|
+
# mypy
|
|
138
|
+
.mypy_cache/
|
|
139
|
+
.dmypy.json
|
|
140
|
+
dmypy.json
|
|
141
|
+
|
|
142
|
+
# ruff
|
|
143
|
+
.ruff_cache/
|
|
144
|
+
|
|
145
|
+
# Pyre type checker
|
|
146
|
+
.pyre/
|
|
147
|
+
|
|
148
|
+
# pytype static type analyzer
|
|
149
|
+
.pytype/
|
|
150
|
+
|
|
151
|
+
# Cython debug symbols
|
|
152
|
+
cython_debug/
|
|
153
|
+
|
|
154
|
+
# OS generated files
|
|
155
|
+
.DS_Store
|
|
156
|
+
.DS_Store?
|
|
157
|
+
._*
|
|
158
|
+
.Spotlight-V100
|
|
159
|
+
.Trashes
|
|
160
|
+
ehthumbs.db
|
|
161
|
+
Thumbs.db
|
|
162
|
+
|
|
163
|
+
# Project specific
|
|
164
|
+
debug_cca.py
|
|
165
|
+
debug_pca.py
|
|
166
|
+
*.py.bak
|
|
167
|
+
|
|
168
|
+
# Output data and artifacts
|
|
169
|
+
output/
|
|
@@ -0,0 +1,58 @@
|
|
|
1
|
+
# CLAUDE.md
|
|
2
|
+
|
|
3
|
+
This file provides guidance to Claude Code (claude.ai/code) when working with code in this repository.
|
|
4
|
+
|
|
5
|
+
## Build & Development Commands
|
|
6
|
+
|
|
7
|
+
```bash
|
|
8
|
+
pip install -e ".[dev]" # Editable install with dev tools (pytest, ruff, mypy)
|
|
9
|
+
pip install -e ".[plot]" # Include matplotlib for plotting
|
|
10
|
+
pytest # Run all tests
|
|
11
|
+
pytest tests/test_core/test_aggregate.py # Run a single test file
|
|
12
|
+
pytest -k "test_pca" # Run tests matching a name pattern
|
|
13
|
+
ruff check src/ # Lint source code
|
|
14
|
+
mypy src/ # Static type checking
|
|
15
|
+
```
|
|
16
|
+
|
|
17
|
+
No CLI entry point exists — the package is a library used via `import pyFracAggregate as pfa`.
|
|
18
|
+
|
|
19
|
+
## Architecture
|
|
20
|
+
|
|
21
|
+
**Four-layer design**: core → generators → analysis → io
|
|
22
|
+
|
|
23
|
+
### Core (`src/pyFracAggregate/core/`)
|
|
24
|
+
- **Aggregate**: Central data structure. Pre-allocated `(max_particles, 5)` NumPy array storing `[x, y, z, radius, mass]`. Properties `positions`, `radii`, `masses` return zero-copy views into the backing array.
|
|
25
|
+
- **ParticleDistribution**: ABC with `Monodisperse(radius)` and `LognormalDistribution(mean, std)` implementations. Generators call `sample(n)` to get particle sizes.
|
|
26
|
+
|
|
27
|
+
### Generators (`src/pyFracAggregate/generators/`)
|
|
28
|
+
- **BaseGenerator**: ABC accepting `(n_particles, df, kf, particle_dist, overlap_tolerance, placement='algebraic')`. All generators produce an `Aggregate` via `generate()`.
|
|
29
|
+
- **Factory**: `get_generator(method, ...)` dispatches to:
|
|
30
|
+
- `'pca'` → `PCAGenerator` — particle-cluster aggregation
|
|
31
|
+
- `'cca'` → `CCAGenerator` — cluster-cluster aggregation
|
|
32
|
+
- `'fracval'` → `FracVALGenerator` — FracVAL algorithm
|
|
33
|
+
- `'tdcca'` → `ThouyJullienGenerator` — Thouy & Jullien (2004) algorithm
|
|
34
|
+
- All generators share the same constructor signature from `BaseGenerator`.
|
|
35
|
+
|
|
36
|
+
#### Placement Strategy Layer (`src/pyFracAggregate/generators/placement/`)
|
|
37
|
+
- **PlacementStrategy** ABC with `place_particle()` (PCA stage) and `merge_clusters()` (CCA stage).
|
|
38
|
+
- **AlgebraicPlacement** (FLAGE, Skorupski et al., 2014): Algebraic touching-point computation with random Monte Carlo fallback. Default strategy.
|
|
39
|
+
- **RandomPlacement** (Filippov et al., 2000): Pure random Monte Carlo sampling with tolerance relaxation.
|
|
40
|
+
- **`get_placement(name)`** factory returns a `PlacementStrategy` by name (`'algebraic'` or `'random'`).
|
|
41
|
+
- **`_helpers.py`**: Shared Monte Carlo helpers (`random_monte_carlo_place`, `random_monte_carlo_merge`) used by both strategies.
|
|
42
|
+
|
|
43
|
+
### Analysis (`src/pyFracAggregate/analysis/`)
|
|
44
|
+
- `morphology`: `radius_of_gyration()`, `center_of_mass()`
|
|
45
|
+
- `correlation`: `pair_correlation_function()`, `estimate_fractal_dimension()`, `plot_pair_correlation()`
|
|
46
|
+
|
|
47
|
+
### IO (`src/pyFracAggregate/io/`)
|
|
48
|
+
- **data.py**: `export_yaml()` — full aggregate snapshot (data, generation params, analysis results)
|
|
49
|
+
- **vtk.py**: `export_vtm()` (MultiBlock) and `export_vtk()` (point cloud) via pyvista
|
|
50
|
+
|
|
51
|
+
### Top-level API (`__init__.py`)
|
|
52
|
+
`pfa.generate(n_particles, df, kf, method, placement='algebraic')` and `pfa.analyze(aggregate)` are the primary entry points. `generate()` delegates to the factory. The `placement` parameter selects the placement strategy (`'algebraic'` or `'random'`). IO exports include `export_yaml()` (full snapshot), `export_vtk()` (point cloud), and `export_vtm()` (MultiBlock).
|
|
53
|
+
|
|
54
|
+
## Key Conventions
|
|
55
|
+
- Python 3.9+, type hints throughout
|
|
56
|
+
- Physical units (`length_unit`, `mass_unit`, `density`) are part of `Aggregate` and `BaseGenerator`
|
|
57
|
+
- `mathutils` package used for 3D math (with scipy fallback)
|
|
58
|
+
- Tests live in `tests/` mirroring the source layout (`test_core/`, `test_generators/`, `test_analysis/`, `test_io/`)
|
|
@@ -0,0 +1,21 @@
|
|
|
1
|
+
MIT License
|
|
2
|
+
|
|
3
|
+
Copyright (c) 2025 Fan Zhang
|
|
4
|
+
|
|
5
|
+
Permission is hereby granted, free of charge, to any person obtaining a copy
|
|
6
|
+
of this software and associated documentation files (the "Software"), to deal
|
|
7
|
+
in the Software without restriction, including without limitation the rights
|
|
8
|
+
to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
|
|
9
|
+
copies of the Software, and to permit persons to whom the Software is
|
|
10
|
+
furnished to do so, subject to the following conditions:
|
|
11
|
+
|
|
12
|
+
The above copyright notice and this permission notice shall be included in all
|
|
13
|
+
copies or substantial portions of the Software.
|
|
14
|
+
|
|
15
|
+
THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
|
|
16
|
+
IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
|
|
17
|
+
FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
|
|
18
|
+
AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
|
|
19
|
+
LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
|
|
20
|
+
OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
|
|
21
|
+
SOFTWARE.
|
|
@@ -0,0 +1,24 @@
|
|
|
1
|
+
Metadata-Version: 2.4
|
|
2
|
+
Name: pyFracAggregate
|
|
3
|
+
Version: 0.1.0
|
|
4
|
+
Summary: 通用分形团簇生成框架 (General Fractal Aggregate Generation Framework)
|
|
5
|
+
Author-email: Fan Zhang <vanvonzhang@gmail.com>
|
|
6
|
+
License-File: LICENSE
|
|
7
|
+
Requires-Python: >=3.9
|
|
8
|
+
Requires-Dist: mathutils>=3.0.0
|
|
9
|
+
Requires-Dist: numpy>=1.21.0
|
|
10
|
+
Requires-Dist: pyvista
|
|
11
|
+
Requires-Dist: pyyaml
|
|
12
|
+
Requires-Dist: scipy>=1.7.0
|
|
13
|
+
Provides-Extra: dev
|
|
14
|
+
Requires-Dist: mypy; extra == 'dev'
|
|
15
|
+
Requires-Dist: pytest; extra == 'dev'
|
|
16
|
+
Requires-Dist: ruff; extra == 'dev'
|
|
17
|
+
Provides-Extra: plot
|
|
18
|
+
Requires-Dist: imageio[ffmpeg]>=2.9.0; extra == 'plot'
|
|
19
|
+
Requires-Dist: matplotlib>=3.5.0; extra == 'plot'
|
|
20
|
+
Description-Content-Type: text/markdown
|
|
21
|
+
|
|
22
|
+
# pyFracAggregate
|
|
23
|
+
|
|
24
|
+
通用分形团簇生成框架 (General Fractal Aggregate Generation Framework).
|