ptlasso 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.
- ptlasso-0.1.0/.gitignore +26 -0
- ptlasso-0.1.0/LICENSE +21 -0
- ptlasso-0.1.0/PKG-INFO +328 -0
- ptlasso-0.1.0/README.md +276 -0
- ptlasso-0.1.0/pyproject.toml +65 -0
- ptlasso-0.1.0/src/ptlasso/__init__.py +53 -0
- ptlasso-0.1.0/src/ptlasso/_base.py +22 -0
- ptlasso-0.1.0/src/ptlasso/_constants.py +34 -0
- ptlasso-0.1.0/src/ptlasso/_plot.py +330 -0
- ptlasso-0.1.0/src/ptlasso/_ptlasso.py +1009 -0
- ptlasso-0.1.0/src/ptlasso/_simulate.py +202 -0
- ptlasso-0.1.0/src/ptlasso/_support.py +164 -0
- ptlasso-0.1.0/tests/__init__.py +0 -0
- ptlasso-0.1.0/tests/test_ptlasso.py +383 -0
ptlasso-0.1.0/.gitignore
ADDED
|
@@ -0,0 +1,26 @@
|
|
|
1
|
+
# Python
|
|
2
|
+
__pycache__/
|
|
3
|
+
*.py[cod]
|
|
4
|
+
*.egg-info/
|
|
5
|
+
dist/
|
|
6
|
+
build/
|
|
7
|
+
.eggs/
|
|
8
|
+
|
|
9
|
+
# Virtual environments
|
|
10
|
+
.venv/
|
|
11
|
+
venv/
|
|
12
|
+
env/
|
|
13
|
+
|
|
14
|
+
# Testing
|
|
15
|
+
.pytest_cache/
|
|
16
|
+
.coverage
|
|
17
|
+
htmlcov/
|
|
18
|
+
|
|
19
|
+
# Tools
|
|
20
|
+
.ruff_cache/
|
|
21
|
+
|
|
22
|
+
# Jupyter
|
|
23
|
+
.ipynb_checkpoints/
|
|
24
|
+
|
|
25
|
+
# macOS
|
|
26
|
+
.DS_Store
|
ptlasso-0.1.0/LICENSE
ADDED
|
@@ -0,0 +1,21 @@
|
|
|
1
|
+
MIT License
|
|
2
|
+
|
|
3
|
+
Copyright (c) 2026 ptlasso authors
|
|
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.
|
ptlasso-0.1.0/PKG-INFO
ADDED
|
@@ -0,0 +1,328 @@
|
|
|
1
|
+
Metadata-Version: 2.4
|
|
2
|
+
Name: ptlasso
|
|
3
|
+
Version: 0.1.0
|
|
4
|
+
Summary: Pretrained Lasso: a two-step procedure for sparse linear models with grouped samples
|
|
5
|
+
Project-URL: Homepage, https://github.com/tlemenestrel/ptlasso
|
|
6
|
+
Project-URL: Repository, https://github.com/tlemenestrel/ptlasso
|
|
7
|
+
Project-URL: Bug Tracker, https://github.com/tlemenestrel/ptlasso/issues
|
|
8
|
+
Author: Erin Craig, Thomas Le Menestrel, Robert Tibshirani
|
|
9
|
+
License: MIT License
|
|
10
|
+
|
|
11
|
+
Copyright (c) 2026 ptlasso authors
|
|
12
|
+
|
|
13
|
+
Permission is hereby granted, free of charge, to any person obtaining a copy
|
|
14
|
+
of this software and associated documentation files (the "Software"), to deal
|
|
15
|
+
in the Software without restriction, including without limitation the rights
|
|
16
|
+
to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
|
|
17
|
+
copies of the Software, and to permit persons to whom the Software is
|
|
18
|
+
furnished to do so, subject to the following conditions:
|
|
19
|
+
|
|
20
|
+
The above copyright notice and this permission notice shall be included in all
|
|
21
|
+
copies or substantial portions of the Software.
|
|
22
|
+
|
|
23
|
+
THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
|
|
24
|
+
IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
|
|
25
|
+
FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
|
|
26
|
+
AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
|
|
27
|
+
LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
|
|
28
|
+
OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
|
|
29
|
+
SOFTWARE.
|
|
30
|
+
License-File: LICENSE
|
|
31
|
+
Keywords: grouped data,lasso,machine learning,pretraining,regularization,sparse,statistics
|
|
32
|
+
Classifier: Development Status :: 3 - Alpha
|
|
33
|
+
Classifier: Intended Audience :: Science/Research
|
|
34
|
+
Classifier: License :: OSI Approved :: MIT License
|
|
35
|
+
Classifier: Programming Language :: Python :: 3
|
|
36
|
+
Classifier: Programming Language :: Python :: 3.9
|
|
37
|
+
Classifier: Programming Language :: Python :: 3.10
|
|
38
|
+
Classifier: Programming Language :: Python :: 3.11
|
|
39
|
+
Classifier: Programming Language :: Python :: 3.12
|
|
40
|
+
Classifier: Topic :: Scientific/Engineering :: Artificial Intelligence
|
|
41
|
+
Classifier: Topic :: Scientific/Engineering :: Mathematics
|
|
42
|
+
Requires-Python: >=3.9
|
|
43
|
+
Requires-Dist: adelie>=1.0
|
|
44
|
+
Requires-Dist: matplotlib>=3.5
|
|
45
|
+
Requires-Dist: numpy>=1.22
|
|
46
|
+
Requires-Dist: scikit-learn>=1.1
|
|
47
|
+
Provides-Extra: dev
|
|
48
|
+
Requires-Dist: pytest; extra == 'dev'
|
|
49
|
+
Requires-Dist: pytest-cov; extra == 'dev'
|
|
50
|
+
Requires-Dist: ruff; extra == 'dev'
|
|
51
|
+
Description-Content-Type: text/markdown
|
|
52
|
+
|
|
53
|
+
# ptlasso
|
|
54
|
+
|
|
55
|
+
Python implementation of the **Pretrained Lasso** — a two-step procedure for fitting sparse linear models when samples belong to distinct groups, leveraging shared structure across groups via pretraining.
|
|
56
|
+
|
|
57
|
+
Based on:
|
|
58
|
+
> Craig, E., Pilanci, M., Le Menestrel, T., Narasimhan, B., Rivas, M. A., Gullaksen, S. E., ... & Tibshirani, R. (2025). Pretraining and the lasso. *Journal of the Royal Statistical Society Series B: Statistical Methodology*, qkaf050.
|
|
59
|
+
|
|
60
|
+
---
|
|
61
|
+
|
|
62
|
+
## The idea
|
|
63
|
+
|
|
64
|
+
Standard group-specific Lasso models are fit independently per group, ignoring shared signal. The Pretrained Lasso fits in two steps:
|
|
65
|
+
|
|
66
|
+
**Step 1 — Overall model.** Fit a Lasso on all samples to capture shared structure:
|
|
67
|
+
|
|
68
|
+
$$\hat{\beta}^{\text{overall}} = \arg\min_\beta \frac{1}{2n}\|y - X\beta\|^2 + \lambda\|\beta\|_1$$
|
|
69
|
+
|
|
70
|
+
**Step 2 — Group models.** For each group $k$, fit a Lasso with an offset equal to $\alpha$ times the overall model's linear predictor:
|
|
71
|
+
|
|
72
|
+
$$\hat{\beta}^{(k)} = \arg\min_\beta \frac{1}{2n_k}\|y^{(k)} - \underbrace{\alpha \cdot X^{(k)}\hat{\beta}^{\text{overall}}}_{\text{offset}} - X^{(k)}\beta\|^2 + \lambda_k\|\beta\|_1$$
|
|
73
|
+
|
|
74
|
+
The parameter $\alpha \in [0, 1]$ controls the pretraining strength:
|
|
75
|
+
- $\alpha = 0$: pure group-specific models, no pretraining
|
|
76
|
+
- $\alpha = 1$: group models explain residuals from the overall model
|
|
77
|
+
- $\alpha \in (0, 1)$: group models are anchored to the overall fit
|
|
78
|
+
|
|
79
|
+
Final prediction for group $k$: $\hat{y}^{(k)} = \alpha \cdot X^{(k)}\hat{\beta}^{\text{overall}} + X^{(k)}\hat{\beta}^{(k)}$
|
|
80
|
+
|
|
81
|
+
Supports **gaussian**, **binomial**, and **multinomial** families.
|
|
82
|
+
|
|
83
|
+
---
|
|
84
|
+
|
|
85
|
+
## Installation
|
|
86
|
+
|
|
87
|
+
```bash
|
|
88
|
+
pip install ptlasso
|
|
89
|
+
```
|
|
90
|
+
|
|
91
|
+
Requires Python ≥ 3.9 and [adelie](https://github.com/JamesYang007/adelie) for the underlying Lasso solver, which supports fitting with offsets (unlike scikit-learn).
|
|
92
|
+
|
|
93
|
+
---
|
|
94
|
+
|
|
95
|
+
## Quick start
|
|
96
|
+
|
|
97
|
+
```python
|
|
98
|
+
import numpy as np
|
|
99
|
+
from ptlasso import PretrainedLasso, PretrainedLassoCV
|
|
100
|
+
|
|
101
|
+
rng = np.random.default_rng(42)
|
|
102
|
+
n, p, k = 300, 100, 3
|
|
103
|
+
|
|
104
|
+
X = rng.standard_normal((n, p))
|
|
105
|
+
groups = rng.integers(0, k, size=n)
|
|
106
|
+
beta = np.zeros(p)
|
|
107
|
+
beta[:5] = [2, -1.5, 1, -0.8, 0.5]
|
|
108
|
+
y = X @ beta + 0.5 * rng.standard_normal(n)
|
|
109
|
+
|
|
110
|
+
# Fixed alpha
|
|
111
|
+
model = PretrainedLasso(alpha=0.5)
|
|
112
|
+
model.fit(X, y, groups)
|
|
113
|
+
print(model)
|
|
114
|
+
# PretrainedLasso(alpha=0.5, family='gaussian', overall_lambda='lambda.1se', ...)
|
|
115
|
+
# family : gaussian
|
|
116
|
+
# n_features : 100
|
|
117
|
+
# n_groups : 3
|
|
118
|
+
# overall |Ŝ| : |Ŝ| = 5 / 100 [0, 1, 2, 3, 4]
|
|
119
|
+
# pretrain |Ŝ| : 0: |Ŝ|=5, 1: |Ŝ|=4, 2: |Ŝ|=6
|
|
120
|
+
|
|
121
|
+
y_pred = model.predict(X, groups)
|
|
122
|
+
print("R²:", model.score(X, y, groups))
|
|
123
|
+
|
|
124
|
+
# Cross-validate over alpha
|
|
125
|
+
cv = PretrainedLassoCV(alphas=[0.0, 0.25, 0.5, 0.75, 1.0])
|
|
126
|
+
cv.fit(X, y, groups)
|
|
127
|
+
print("Best alpha:", cv.alpha_)
|
|
128
|
+
```
|
|
129
|
+
|
|
130
|
+
---
|
|
131
|
+
|
|
132
|
+
## Families
|
|
133
|
+
|
|
134
|
+
```python
|
|
135
|
+
# Binary classification
|
|
136
|
+
model = PretrainedLasso(alpha=0.5, family="binomial")
|
|
137
|
+
model.fit(X, y_binary, groups)
|
|
138
|
+
probs = model.predict(X, groups) # shape (n,), P(y=1)
|
|
139
|
+
|
|
140
|
+
# Multi-class classification (integer labels 0..K-1)
|
|
141
|
+
model = PretrainedLasso(alpha=0.5, family="multinomial")
|
|
142
|
+
model.fit(X, y_multiclass, groups)
|
|
143
|
+
probs = model.predict(X, groups) # shape (n, K)
|
|
144
|
+
```
|
|
145
|
+
|
|
146
|
+
---
|
|
147
|
+
|
|
148
|
+
## Feature names and group labels
|
|
149
|
+
|
|
150
|
+
Both `fit()` methods accept human-readable names. pandas DataFrames are supported natively — column names are picked up automatically.
|
|
151
|
+
|
|
152
|
+
```python
|
|
153
|
+
import pandas as pd
|
|
154
|
+
|
|
155
|
+
X_df = pd.DataFrame(X, columns=[f"gene_{i}" for i in range(p)])
|
|
156
|
+
group_labels = {0: "control", 1: "treated_A", 2: "treated_B"}
|
|
157
|
+
|
|
158
|
+
model = PretrainedLasso(alpha=0.5)
|
|
159
|
+
model.fit(X_df, y, groups, group_labels=group_labels)
|
|
160
|
+
# overall |Ŝ| : |Ŝ| = 5 / 100 [gene_0, gene_1, gene_2, gene_3, gene_4]
|
|
161
|
+
# pretrain |Ŝ| : control: |Ŝ|=5, treated_A: |Ŝ|=4, treated_B: |Ŝ|=6
|
|
162
|
+
```
|
|
163
|
+
|
|
164
|
+
---
|
|
165
|
+
|
|
166
|
+
## Inspecting the support
|
|
167
|
+
|
|
168
|
+
```python
|
|
169
|
+
from ptlasso import (
|
|
170
|
+
get_overall_support,
|
|
171
|
+
get_pretrain_support,
|
|
172
|
+
get_pretrain_support_split,
|
|
173
|
+
get_individual_support,
|
|
174
|
+
)
|
|
175
|
+
|
|
176
|
+
get_overall_support(model) # features from the overall model
|
|
177
|
+
get_pretrain_support(model) # union across pretrained group models
|
|
178
|
+
get_pretrain_support(model, common_only=True) # features selected by >50% of groups
|
|
179
|
+
get_pretrain_support(model, groups=[0, 1]) # restrict to specific groups
|
|
180
|
+
get_individual_support(model) # features from no-pretraining baselines
|
|
181
|
+
|
|
182
|
+
common, indiv = get_pretrain_support_split(model)
|
|
183
|
+
# common : features from the overall model (stage 1)
|
|
184
|
+
# indiv : additional features picked up by group models (stage 2)
|
|
185
|
+
```
|
|
186
|
+
|
|
187
|
+
---
|
|
188
|
+
|
|
189
|
+
## Evaluating all sub-models at once
|
|
190
|
+
|
|
191
|
+
```python
|
|
192
|
+
result = model.evaluate(X_test, y_test, groups_test)
|
|
193
|
+
# {"pretrain": {"predictions": ..., "score": ...},
|
|
194
|
+
# "individual": {"predictions": ..., "score": ...},
|
|
195
|
+
# "overall": {"predictions": ..., "score": ...}}
|
|
196
|
+
```
|
|
197
|
+
|
|
198
|
+
---
|
|
199
|
+
|
|
200
|
+
## Retrieving coefficients
|
|
201
|
+
|
|
202
|
+
```python
|
|
203
|
+
coefs = model.get_coef() # all sub-models
|
|
204
|
+
coefs["overall"] # {"coef": ndarray, "intercept": ndarray}
|
|
205
|
+
coefs["pretrain"]["control"] # {"coef": ndarray, "intercept": ndarray}
|
|
206
|
+
coefs["individual"]["treated_A"]
|
|
207
|
+
|
|
208
|
+
model.get_coef(model="pretrain") # just pretrain sub-dict
|
|
209
|
+
```
|
|
210
|
+
|
|
211
|
+
---
|
|
212
|
+
|
|
213
|
+
## CV details
|
|
214
|
+
|
|
215
|
+
```python
|
|
216
|
+
cv = PretrainedLassoCV(
|
|
217
|
+
alphas=[0.0, 0.25, 0.5, 0.75, 1.0],
|
|
218
|
+
cv=5,
|
|
219
|
+
alphahat_choice="overall", # or "mean" (unweighted mean of per-group CV errors)
|
|
220
|
+
family="gaussian",
|
|
221
|
+
overall_lambda="lambda.1se", # or "lambda.min"
|
|
222
|
+
foldid=my_foldid, # optional: custom integer fold assignments
|
|
223
|
+
)
|
|
224
|
+
cv.fit(X, y, groups)
|
|
225
|
+
|
|
226
|
+
cv.alpha_ # globally best alpha
|
|
227
|
+
cv.varying_alphahat_ # {group: best_alpha} per group
|
|
228
|
+
cv.cv_results_ # {alpha: mean CV loss}
|
|
229
|
+
cv.cv_results_se_ # {alpha: SE of CV loss}
|
|
230
|
+
cv.cv_results_per_group_ # {alpha: {group: mean CV loss}}
|
|
231
|
+
cv.cv_results_mean_ # {alpha: unweighted mean of per-group losses}
|
|
232
|
+
cv.cv_results_wtd_mean_ # {alpha: size-weighted mean of per-group losses}
|
|
233
|
+
cv.cv_results_individual_ # CV loss for individual (no-pretraining) baseline
|
|
234
|
+
cv.cv_results_overall_ # CV loss for overall model baseline
|
|
235
|
+
cv.best_estimator_ # PretrainedLasso fitted with alpha_
|
|
236
|
+
cv.all_estimators_ # {alpha: PretrainedLasso} for varying-alpha prediction
|
|
237
|
+
|
|
238
|
+
# Predict using each group's own best alpha
|
|
239
|
+
cv.predict(X, groups, alphatype="varying")
|
|
240
|
+
cv.evaluate(X, y, groups, alphatype="varying")
|
|
241
|
+
```
|
|
242
|
+
|
|
243
|
+
---
|
|
244
|
+
|
|
245
|
+
## Plotting
|
|
246
|
+
|
|
247
|
+
```python
|
|
248
|
+
from ptlasso import plot_cv, plot_paths
|
|
249
|
+
|
|
250
|
+
plot_cv(cv) # CV loss curve over alpha with ±1 SE band
|
|
251
|
+
plot_paths(model) # regularisation paths for all sub-models
|
|
252
|
+
```
|
|
253
|
+
|
|
254
|
+
---
|
|
255
|
+
|
|
256
|
+
## API reference
|
|
257
|
+
|
|
258
|
+
### `PretrainedLasso`
|
|
259
|
+
|
|
260
|
+
| Parameter | Default | Description |
|
|
261
|
+
|-----------|---------|-------------|
|
|
262
|
+
| `alpha` | `0.5` | Pretraining strength $\in [0, 1]$ |
|
|
263
|
+
| `family` | `"gaussian"` | `"gaussian"`, `"binomial"`, or `"multinomial"` |
|
|
264
|
+
| `overall_lambda` | `"lambda.1se"` | Lambda rule for stage-1 offset: `"lambda.1se"` or `"lambda.min"` |
|
|
265
|
+
| `fit_intercept` | `True` | Fit an intercept in all sub-models |
|
|
266
|
+
| `lmda_path_size` | `100` | Number of $\lambda$ values in the regularisation path |
|
|
267
|
+
| `min_ratio` | `0.01` | Ratio of smallest to largest $\lambda$ |
|
|
268
|
+
| `verbose` | `False` | Show adelie progress bar |
|
|
269
|
+
|
|
270
|
+
**Methods:**
|
|
271
|
+
- `fit(X, y, groups, group_labels=None, feature_names=None)`
|
|
272
|
+
- `predict(X, groups, model="pretrain", lmda_idx=None)` — `model` ∈ `{"pretrain", "individual", "overall"}`
|
|
273
|
+
- `score(X, y, groups)` — R² or accuracy
|
|
274
|
+
- `evaluate(X, y, groups)` — predict + score for all three sub-models
|
|
275
|
+
- `get_coef(model="all", lmda_idx=None)`
|
|
276
|
+
|
|
277
|
+
### `PretrainedLassoCV`
|
|
278
|
+
|
|
279
|
+
| Parameter | Default | Description |
|
|
280
|
+
|-----------|---------|-------------|
|
|
281
|
+
| `alphas` | `[0, 0.25, 0.5, 0.75, 1.0]` | Candidate $\alpha$ values |
|
|
282
|
+
| `cv` | `5` | Number of CV folds |
|
|
283
|
+
| `alphahat_choice` | `"overall"` | `"overall"` or `"mean"` (unweighted per-group mean) |
|
|
284
|
+
| `family` | `"gaussian"` | Same as `PretrainedLasso` |
|
|
285
|
+
| `overall_lambda` | `"lambda.1se"` | Same as `PretrainedLasso` |
|
|
286
|
+
| `fit_intercept` | `True` | |
|
|
287
|
+
| `lmda_path_size` | `100` | |
|
|
288
|
+
| `min_ratio` | `0.01` | |
|
|
289
|
+
| `verbose` | `False` | |
|
|
290
|
+
| `foldid` | `None` | Integer array of fold assignments (overrides `cv`) |
|
|
291
|
+
|
|
292
|
+
Same `fit` / `predict` / `score` / `evaluate` / `get_coef` interface as `PretrainedLasso`, plus:
|
|
293
|
+
|
|
294
|
+
| Fitted attribute | Description |
|
|
295
|
+
|-----------------|-------------|
|
|
296
|
+
| `alpha_` | Best $\alpha$ selected by CV |
|
|
297
|
+
| `varying_alphahat_` | `{group: alpha}` — per-group best $\alpha$ |
|
|
298
|
+
| `cv_results_` | `{alpha: mean CV loss}` |
|
|
299
|
+
| `cv_results_se_` | `{alpha: SE of CV loss}` |
|
|
300
|
+
| `cv_results_per_group_` | `{alpha: {group: mean CV loss}}` |
|
|
301
|
+
| `cv_results_mean_` | `{alpha: unweighted mean of per-group losses}` |
|
|
302
|
+
| `cv_results_wtd_mean_` | `{alpha: size-weighted mean of per-group losses}` |
|
|
303
|
+
| `cv_results_individual_` | CV loss for individual baseline |
|
|
304
|
+
| `cv_results_overall_` | CV loss for overall baseline |
|
|
305
|
+
| `best_estimator_` | `PretrainedLasso` fitted with `alpha_` |
|
|
306
|
+
| `all_estimators_` | `{alpha: PretrainedLasso}` for each unique varying alpha |
|
|
307
|
+
|
|
308
|
+
`predict` also accepts `alphatype="varying"` to route each group through its own best alpha.
|
|
309
|
+
|
|
310
|
+
---
|
|
311
|
+
|
|
312
|
+
## Citation
|
|
313
|
+
|
|
314
|
+
```bibtex
|
|
315
|
+
@article{craig2025pretraining,
|
|
316
|
+
title = {Pretraining and the lasso},
|
|
317
|
+
author = {Craig, Erin and Pilanci, Mert and Le Menestrel, Thomas and Narasimhan, Balasubramanian and Rivas, Manuel A. and Gullaksen, Stein-Erik and Tibshirani, Robert},
|
|
318
|
+
journal = {Journal of the Royal Statistical Society Series B: Statistical Methodology},
|
|
319
|
+
pages = {qkaf050},
|
|
320
|
+
year = {2025}
|
|
321
|
+
}
|
|
322
|
+
```
|
|
323
|
+
|
|
324
|
+
---
|
|
325
|
+
|
|
326
|
+
## License
|
|
327
|
+
|
|
328
|
+
MIT
|
ptlasso-0.1.0/README.md
ADDED
|
@@ -0,0 +1,276 @@
|
|
|
1
|
+
# ptlasso
|
|
2
|
+
|
|
3
|
+
Python implementation of the **Pretrained Lasso** — a two-step procedure for fitting sparse linear models when samples belong to distinct groups, leveraging shared structure across groups via pretraining.
|
|
4
|
+
|
|
5
|
+
Based on:
|
|
6
|
+
> Craig, E., Pilanci, M., Le Menestrel, T., Narasimhan, B., Rivas, M. A., Gullaksen, S. E., ... & Tibshirani, R. (2025). Pretraining and the lasso. *Journal of the Royal Statistical Society Series B: Statistical Methodology*, qkaf050.
|
|
7
|
+
|
|
8
|
+
---
|
|
9
|
+
|
|
10
|
+
## The idea
|
|
11
|
+
|
|
12
|
+
Standard group-specific Lasso models are fit independently per group, ignoring shared signal. The Pretrained Lasso fits in two steps:
|
|
13
|
+
|
|
14
|
+
**Step 1 — Overall model.** Fit a Lasso on all samples to capture shared structure:
|
|
15
|
+
|
|
16
|
+
$$\hat{\beta}^{\text{overall}} = \arg\min_\beta \frac{1}{2n}\|y - X\beta\|^2 + \lambda\|\beta\|_1$$
|
|
17
|
+
|
|
18
|
+
**Step 2 — Group models.** For each group $k$, fit a Lasso with an offset equal to $\alpha$ times the overall model's linear predictor:
|
|
19
|
+
|
|
20
|
+
$$\hat{\beta}^{(k)} = \arg\min_\beta \frac{1}{2n_k}\|y^{(k)} - \underbrace{\alpha \cdot X^{(k)}\hat{\beta}^{\text{overall}}}_{\text{offset}} - X^{(k)}\beta\|^2 + \lambda_k\|\beta\|_1$$
|
|
21
|
+
|
|
22
|
+
The parameter $\alpha \in [0, 1]$ controls the pretraining strength:
|
|
23
|
+
- $\alpha = 0$: pure group-specific models, no pretraining
|
|
24
|
+
- $\alpha = 1$: group models explain residuals from the overall model
|
|
25
|
+
- $\alpha \in (0, 1)$: group models are anchored to the overall fit
|
|
26
|
+
|
|
27
|
+
Final prediction for group $k$: $\hat{y}^{(k)} = \alpha \cdot X^{(k)}\hat{\beta}^{\text{overall}} + X^{(k)}\hat{\beta}^{(k)}$
|
|
28
|
+
|
|
29
|
+
Supports **gaussian**, **binomial**, and **multinomial** families.
|
|
30
|
+
|
|
31
|
+
---
|
|
32
|
+
|
|
33
|
+
## Installation
|
|
34
|
+
|
|
35
|
+
```bash
|
|
36
|
+
pip install ptlasso
|
|
37
|
+
```
|
|
38
|
+
|
|
39
|
+
Requires Python ≥ 3.9 and [adelie](https://github.com/JamesYang007/adelie) for the underlying Lasso solver, which supports fitting with offsets (unlike scikit-learn).
|
|
40
|
+
|
|
41
|
+
---
|
|
42
|
+
|
|
43
|
+
## Quick start
|
|
44
|
+
|
|
45
|
+
```python
|
|
46
|
+
import numpy as np
|
|
47
|
+
from ptlasso import PretrainedLasso, PretrainedLassoCV
|
|
48
|
+
|
|
49
|
+
rng = np.random.default_rng(42)
|
|
50
|
+
n, p, k = 300, 100, 3
|
|
51
|
+
|
|
52
|
+
X = rng.standard_normal((n, p))
|
|
53
|
+
groups = rng.integers(0, k, size=n)
|
|
54
|
+
beta = np.zeros(p)
|
|
55
|
+
beta[:5] = [2, -1.5, 1, -0.8, 0.5]
|
|
56
|
+
y = X @ beta + 0.5 * rng.standard_normal(n)
|
|
57
|
+
|
|
58
|
+
# Fixed alpha
|
|
59
|
+
model = PretrainedLasso(alpha=0.5)
|
|
60
|
+
model.fit(X, y, groups)
|
|
61
|
+
print(model)
|
|
62
|
+
# PretrainedLasso(alpha=0.5, family='gaussian', overall_lambda='lambda.1se', ...)
|
|
63
|
+
# family : gaussian
|
|
64
|
+
# n_features : 100
|
|
65
|
+
# n_groups : 3
|
|
66
|
+
# overall |Ŝ| : |Ŝ| = 5 / 100 [0, 1, 2, 3, 4]
|
|
67
|
+
# pretrain |Ŝ| : 0: |Ŝ|=5, 1: |Ŝ|=4, 2: |Ŝ|=6
|
|
68
|
+
|
|
69
|
+
y_pred = model.predict(X, groups)
|
|
70
|
+
print("R²:", model.score(X, y, groups))
|
|
71
|
+
|
|
72
|
+
# Cross-validate over alpha
|
|
73
|
+
cv = PretrainedLassoCV(alphas=[0.0, 0.25, 0.5, 0.75, 1.0])
|
|
74
|
+
cv.fit(X, y, groups)
|
|
75
|
+
print("Best alpha:", cv.alpha_)
|
|
76
|
+
```
|
|
77
|
+
|
|
78
|
+
---
|
|
79
|
+
|
|
80
|
+
## Families
|
|
81
|
+
|
|
82
|
+
```python
|
|
83
|
+
# Binary classification
|
|
84
|
+
model = PretrainedLasso(alpha=0.5, family="binomial")
|
|
85
|
+
model.fit(X, y_binary, groups)
|
|
86
|
+
probs = model.predict(X, groups) # shape (n,), P(y=1)
|
|
87
|
+
|
|
88
|
+
# Multi-class classification (integer labels 0..K-1)
|
|
89
|
+
model = PretrainedLasso(alpha=0.5, family="multinomial")
|
|
90
|
+
model.fit(X, y_multiclass, groups)
|
|
91
|
+
probs = model.predict(X, groups) # shape (n, K)
|
|
92
|
+
```
|
|
93
|
+
|
|
94
|
+
---
|
|
95
|
+
|
|
96
|
+
## Feature names and group labels
|
|
97
|
+
|
|
98
|
+
Both `fit()` methods accept human-readable names. pandas DataFrames are supported natively — column names are picked up automatically.
|
|
99
|
+
|
|
100
|
+
```python
|
|
101
|
+
import pandas as pd
|
|
102
|
+
|
|
103
|
+
X_df = pd.DataFrame(X, columns=[f"gene_{i}" for i in range(p)])
|
|
104
|
+
group_labels = {0: "control", 1: "treated_A", 2: "treated_B"}
|
|
105
|
+
|
|
106
|
+
model = PretrainedLasso(alpha=0.5)
|
|
107
|
+
model.fit(X_df, y, groups, group_labels=group_labels)
|
|
108
|
+
# overall |Ŝ| : |Ŝ| = 5 / 100 [gene_0, gene_1, gene_2, gene_3, gene_4]
|
|
109
|
+
# pretrain |Ŝ| : control: |Ŝ|=5, treated_A: |Ŝ|=4, treated_B: |Ŝ|=6
|
|
110
|
+
```
|
|
111
|
+
|
|
112
|
+
---
|
|
113
|
+
|
|
114
|
+
## Inspecting the support
|
|
115
|
+
|
|
116
|
+
```python
|
|
117
|
+
from ptlasso import (
|
|
118
|
+
get_overall_support,
|
|
119
|
+
get_pretrain_support,
|
|
120
|
+
get_pretrain_support_split,
|
|
121
|
+
get_individual_support,
|
|
122
|
+
)
|
|
123
|
+
|
|
124
|
+
get_overall_support(model) # features from the overall model
|
|
125
|
+
get_pretrain_support(model) # union across pretrained group models
|
|
126
|
+
get_pretrain_support(model, common_only=True) # features selected by >50% of groups
|
|
127
|
+
get_pretrain_support(model, groups=[0, 1]) # restrict to specific groups
|
|
128
|
+
get_individual_support(model) # features from no-pretraining baselines
|
|
129
|
+
|
|
130
|
+
common, indiv = get_pretrain_support_split(model)
|
|
131
|
+
# common : features from the overall model (stage 1)
|
|
132
|
+
# indiv : additional features picked up by group models (stage 2)
|
|
133
|
+
```
|
|
134
|
+
|
|
135
|
+
---
|
|
136
|
+
|
|
137
|
+
## Evaluating all sub-models at once
|
|
138
|
+
|
|
139
|
+
```python
|
|
140
|
+
result = model.evaluate(X_test, y_test, groups_test)
|
|
141
|
+
# {"pretrain": {"predictions": ..., "score": ...},
|
|
142
|
+
# "individual": {"predictions": ..., "score": ...},
|
|
143
|
+
# "overall": {"predictions": ..., "score": ...}}
|
|
144
|
+
```
|
|
145
|
+
|
|
146
|
+
---
|
|
147
|
+
|
|
148
|
+
## Retrieving coefficients
|
|
149
|
+
|
|
150
|
+
```python
|
|
151
|
+
coefs = model.get_coef() # all sub-models
|
|
152
|
+
coefs["overall"] # {"coef": ndarray, "intercept": ndarray}
|
|
153
|
+
coefs["pretrain"]["control"] # {"coef": ndarray, "intercept": ndarray}
|
|
154
|
+
coefs["individual"]["treated_A"]
|
|
155
|
+
|
|
156
|
+
model.get_coef(model="pretrain") # just pretrain sub-dict
|
|
157
|
+
```
|
|
158
|
+
|
|
159
|
+
---
|
|
160
|
+
|
|
161
|
+
## CV details
|
|
162
|
+
|
|
163
|
+
```python
|
|
164
|
+
cv = PretrainedLassoCV(
|
|
165
|
+
alphas=[0.0, 0.25, 0.5, 0.75, 1.0],
|
|
166
|
+
cv=5,
|
|
167
|
+
alphahat_choice="overall", # or "mean" (unweighted mean of per-group CV errors)
|
|
168
|
+
family="gaussian",
|
|
169
|
+
overall_lambda="lambda.1se", # or "lambda.min"
|
|
170
|
+
foldid=my_foldid, # optional: custom integer fold assignments
|
|
171
|
+
)
|
|
172
|
+
cv.fit(X, y, groups)
|
|
173
|
+
|
|
174
|
+
cv.alpha_ # globally best alpha
|
|
175
|
+
cv.varying_alphahat_ # {group: best_alpha} per group
|
|
176
|
+
cv.cv_results_ # {alpha: mean CV loss}
|
|
177
|
+
cv.cv_results_se_ # {alpha: SE of CV loss}
|
|
178
|
+
cv.cv_results_per_group_ # {alpha: {group: mean CV loss}}
|
|
179
|
+
cv.cv_results_mean_ # {alpha: unweighted mean of per-group losses}
|
|
180
|
+
cv.cv_results_wtd_mean_ # {alpha: size-weighted mean of per-group losses}
|
|
181
|
+
cv.cv_results_individual_ # CV loss for individual (no-pretraining) baseline
|
|
182
|
+
cv.cv_results_overall_ # CV loss for overall model baseline
|
|
183
|
+
cv.best_estimator_ # PretrainedLasso fitted with alpha_
|
|
184
|
+
cv.all_estimators_ # {alpha: PretrainedLasso} for varying-alpha prediction
|
|
185
|
+
|
|
186
|
+
# Predict using each group's own best alpha
|
|
187
|
+
cv.predict(X, groups, alphatype="varying")
|
|
188
|
+
cv.evaluate(X, y, groups, alphatype="varying")
|
|
189
|
+
```
|
|
190
|
+
|
|
191
|
+
---
|
|
192
|
+
|
|
193
|
+
## Plotting
|
|
194
|
+
|
|
195
|
+
```python
|
|
196
|
+
from ptlasso import plot_cv, plot_paths
|
|
197
|
+
|
|
198
|
+
plot_cv(cv) # CV loss curve over alpha with ±1 SE band
|
|
199
|
+
plot_paths(model) # regularisation paths for all sub-models
|
|
200
|
+
```
|
|
201
|
+
|
|
202
|
+
---
|
|
203
|
+
|
|
204
|
+
## API reference
|
|
205
|
+
|
|
206
|
+
### `PretrainedLasso`
|
|
207
|
+
|
|
208
|
+
| Parameter | Default | Description |
|
|
209
|
+
|-----------|---------|-------------|
|
|
210
|
+
| `alpha` | `0.5` | Pretraining strength $\in [0, 1]$ |
|
|
211
|
+
| `family` | `"gaussian"` | `"gaussian"`, `"binomial"`, or `"multinomial"` |
|
|
212
|
+
| `overall_lambda` | `"lambda.1se"` | Lambda rule for stage-1 offset: `"lambda.1se"` or `"lambda.min"` |
|
|
213
|
+
| `fit_intercept` | `True` | Fit an intercept in all sub-models |
|
|
214
|
+
| `lmda_path_size` | `100` | Number of $\lambda$ values in the regularisation path |
|
|
215
|
+
| `min_ratio` | `0.01` | Ratio of smallest to largest $\lambda$ |
|
|
216
|
+
| `verbose` | `False` | Show adelie progress bar |
|
|
217
|
+
|
|
218
|
+
**Methods:**
|
|
219
|
+
- `fit(X, y, groups, group_labels=None, feature_names=None)`
|
|
220
|
+
- `predict(X, groups, model="pretrain", lmda_idx=None)` — `model` ∈ `{"pretrain", "individual", "overall"}`
|
|
221
|
+
- `score(X, y, groups)` — R² or accuracy
|
|
222
|
+
- `evaluate(X, y, groups)` — predict + score for all three sub-models
|
|
223
|
+
- `get_coef(model="all", lmda_idx=None)`
|
|
224
|
+
|
|
225
|
+
### `PretrainedLassoCV`
|
|
226
|
+
|
|
227
|
+
| Parameter | Default | Description |
|
|
228
|
+
|-----------|---------|-------------|
|
|
229
|
+
| `alphas` | `[0, 0.25, 0.5, 0.75, 1.0]` | Candidate $\alpha$ values |
|
|
230
|
+
| `cv` | `5` | Number of CV folds |
|
|
231
|
+
| `alphahat_choice` | `"overall"` | `"overall"` or `"mean"` (unweighted per-group mean) |
|
|
232
|
+
| `family` | `"gaussian"` | Same as `PretrainedLasso` |
|
|
233
|
+
| `overall_lambda` | `"lambda.1se"` | Same as `PretrainedLasso` |
|
|
234
|
+
| `fit_intercept` | `True` | |
|
|
235
|
+
| `lmda_path_size` | `100` | |
|
|
236
|
+
| `min_ratio` | `0.01` | |
|
|
237
|
+
| `verbose` | `False` | |
|
|
238
|
+
| `foldid` | `None` | Integer array of fold assignments (overrides `cv`) |
|
|
239
|
+
|
|
240
|
+
Same `fit` / `predict` / `score` / `evaluate` / `get_coef` interface as `PretrainedLasso`, plus:
|
|
241
|
+
|
|
242
|
+
| Fitted attribute | Description |
|
|
243
|
+
|-----------------|-------------|
|
|
244
|
+
| `alpha_` | Best $\alpha$ selected by CV |
|
|
245
|
+
| `varying_alphahat_` | `{group: alpha}` — per-group best $\alpha$ |
|
|
246
|
+
| `cv_results_` | `{alpha: mean CV loss}` |
|
|
247
|
+
| `cv_results_se_` | `{alpha: SE of CV loss}` |
|
|
248
|
+
| `cv_results_per_group_` | `{alpha: {group: mean CV loss}}` |
|
|
249
|
+
| `cv_results_mean_` | `{alpha: unweighted mean of per-group losses}` |
|
|
250
|
+
| `cv_results_wtd_mean_` | `{alpha: size-weighted mean of per-group losses}` |
|
|
251
|
+
| `cv_results_individual_` | CV loss for individual baseline |
|
|
252
|
+
| `cv_results_overall_` | CV loss for overall baseline |
|
|
253
|
+
| `best_estimator_` | `PretrainedLasso` fitted with `alpha_` |
|
|
254
|
+
| `all_estimators_` | `{alpha: PretrainedLasso}` for each unique varying alpha |
|
|
255
|
+
|
|
256
|
+
`predict` also accepts `alphatype="varying"` to route each group through its own best alpha.
|
|
257
|
+
|
|
258
|
+
---
|
|
259
|
+
|
|
260
|
+
## Citation
|
|
261
|
+
|
|
262
|
+
```bibtex
|
|
263
|
+
@article{craig2025pretraining,
|
|
264
|
+
title = {Pretraining and the lasso},
|
|
265
|
+
author = {Craig, Erin and Pilanci, Mert and Le Menestrel, Thomas and Narasimhan, Balasubramanian and Rivas, Manuel A. and Gullaksen, Stein-Erik and Tibshirani, Robert},
|
|
266
|
+
journal = {Journal of the Royal Statistical Society Series B: Statistical Methodology},
|
|
267
|
+
pages = {qkaf050},
|
|
268
|
+
year = {2025}
|
|
269
|
+
}
|
|
270
|
+
```
|
|
271
|
+
|
|
272
|
+
---
|
|
273
|
+
|
|
274
|
+
## License
|
|
275
|
+
|
|
276
|
+
MIT
|