scikit-learn/sklearn/pipeline.py

305 lines
11 KiB
Python

"""
The :mod:`sklearn.pipeline` module implements utilites to build a composite
estimator, as a chain of transforms and estimators.
"""
# Author: Edouard Duchesnay
# Gael Varoquaux
# Virgile Fritsch
# Alexandre Gramfort
# Licence: BSD
import numpy as np
from scipy import sparse
from .base import BaseEstimator, TransformerMixin
from .externals.joblib import Parallel, delayed
__all__ = ['Pipeline', 'FeatureUnion']
# One round of beers on me if someone finds out why the backslash
# is needed in the Attributes section so as not to upset sphinx.
class Pipeline(BaseEstimator):
"""Pipeline of transforms with a final estimator.
Sequentially apply a list of transforms and a final estimator.
Intermediate steps of the pipeline must be 'transforms', that is, they
must implements fit and transform methods.
The final estimator needs only implements fit.
The purpose of the pipeline is to assemble several steps that can be
cross-validated together while setting different parameters.
For this, it enables setting parameters of the various steps using their
names and the parameter name separated by a '__', as in the example below.
Parameters
----------
steps: list
List of (name, transform) tuples (implementing fit/transform) that are
chained, in the order in which they are chained, with the last object
an estimator.
Attributes
----------
`steps` : list of (name, object)
List of the named object that compose the pipeline, in the \
order that they are applied on the data.
Examples
--------
>>> from sklearn import svm
>>> from sklearn.datasets import samples_generator
>>> from sklearn.feature_selection import SelectKBest
>>> from sklearn.feature_selection import f_regression
>>> from sklearn.pipeline import Pipeline
>>> # generate some data to play with
>>> X, y = samples_generator.make_classification(
... n_informative=5, n_redundant=0, random_state=42)
>>> # ANOVA SVM-C
>>> anova_filter = SelectKBest(f_regression, k=5)
>>> clf = svm.SVC(kernel='linear')
>>> anova_svm = Pipeline([('anova', anova_filter), ('svc', clf)])
>>> # You can set the parameters using the names issued
>>> # For instance, fit using a k of 10 in the SelectKBest
>>> # and a parameter 'C' of the svn
>>> anova_svm.set_params(anova__k=10, svc__C=.1).fit(X, y)
... # doctest: +ELLIPSIS
Pipeline(steps=[...])
>>> prediction = anova_svm.predict(X)
>>> anova_svm.score(X, y)
0.75
"""
# BaseEstimator interface
def __init__(self, steps):
self.named_steps = dict(steps)
names, estimators = zip(*steps)
if len(self.named_steps) != len(steps):
raise ValueError("Names provided are not unique: %s" % names)
self.steps = zip(names, estimators) # shallow copy of steps
transforms = estimators[:-1]
estimator = estimators[-1]
for t in transforms:
if not (hasattr(t, "fit") or hasattr(t, "fit_transform")) \
or not hasattr(t, "transform"):
raise TypeError("All intermediate steps a the chain should "
"be transforms and implement fit and transform"
"'%s' (type %s) doesn't)" % (t, type(t)))
if not hasattr(estimator, "fit"):
raise TypeError("Last step of chain should implement fit "
"'%s' (type %s) doesn't)" % (estimator, type(estimator)))
def get_params(self, deep=True):
if not deep:
return super(Pipeline, self).get_params(deep=False)
else:
out = self.named_steps.copy()
for name, step in self.named_steps.iteritems():
for key, value in step.get_params(deep=True).iteritems():
out['%s__%s' % (name, key)] = value
return out
# Estimator interface
def _pre_transform(self, X, y=None, **fit_params):
fit_params_steps = dict((step, {}) for step, _ in self.steps)
for pname, pval in fit_params.iteritems():
step, param = pname.split('__', 1)
fit_params_steps[step][param] = pval
Xt = X
for name, transform in self.steps[:-1]:
if hasattr(transform, "fit_transform"):
Xt = transform.fit_transform(Xt, y, **fit_params_steps[name])
else:
Xt = transform.fit(Xt, y, **fit_params_steps[name]) \
.transform(Xt)
return Xt, fit_params_steps[self.steps[-1][0]]
def fit(self, X, y=None, **fit_params):
"""Fit all the transforms one after the other and transform the
data, then fit the transformed data using the final estimator.
"""
Xt, fit_params = self._pre_transform(X, y, **fit_params)
self.steps[-1][-1].fit(Xt, y, **fit_params)
return self
def fit_transform(self, X, y=None, **fit_params):
"""Fit all the transforms one after the other and transform the
data, then use fit_transform on transformed data using the final
estimator. Valid only if the final estimator implements
fit_transform."""
Xt, fit_params = self._pre_transform(X, y, **fit_params)
return self.steps[-1][-1].fit_transform(Xt, y, **fit_params)
def predict(self, X):
"""Applies transforms to the data, and the predict method of the
final estimator. Valid only if the final estimator implements
predict."""
Xt = X
for name, transform in self.steps[:-1]:
Xt = transform.transform(Xt)
return self.steps[-1][-1].predict(Xt)
def predict_proba(self, X):
"""Applies transforms to the data, and the predict_proba method of the
final estimator. Valid only if the final estimator implements
predict_proba."""
Xt = X
for name, transform in self.steps[:-1]:
Xt = transform.transform(Xt)
return self.steps[-1][-1].predict_proba(Xt)
def decision_function(self, X):
"""Applies transforms to the data, and the decision_function method of
the final estimator. Valid only if the final estimator implements
decision_function."""
Xt = X
for name, transform in self.steps[:-1]:
Xt = transform.transform(Xt)
return self.steps[-1][-1].decision_function(Xt)
def predict_log_proba(self, X):
Xt = X
for name, transform in self.steps[:-1]:
Xt = transform.transform(Xt)
return self.steps[-1][-1].predict_log_proba(Xt)
def transform(self, X):
"""Applies transforms to the data, and the transform method of the
final estimator. Valid only if the final estimator implements
transform."""
Xt = X
for name, transform in self.steps:
Xt = transform.transform(Xt)
return Xt
def inverse_transform(self, X):
if X.ndim == 1:
X = X[None, :]
Xt = X
for name, step in self.steps[::-1]:
Xt = step.inverse_transform(Xt)
return Xt
def score(self, X, y=None):
"""Applies transforms to the data, and the score method of the
final estimator. Valid only if the final estimator implements
score."""
Xt = X
for name, transform in self.steps[:-1]:
Xt = transform.transform(Xt)
return self.steps[-1][-1].score(Xt, y)
@property
def _pairwise(self):
# check if first estimator expects pairwise input
return getattr(self.steps[0][1], '_pairwise', False)
def _fit_one_transformer(transformer, X, y):
transformer.fit(X, y)
def _transform_one(transformer, name, X, transformer_weights):
if transformer_weights is not None and name in transformer_weights:
# if we have a weight for this transformer, muliply output
return transformer.transform(X) * transformer_weights[name]
return transformer.transform(X)
class FeatureUnion(BaseEstimator, TransformerMixin):
"""Concatenates results of multiple transformer objects.
This estimator applies a list of transformer objects in parallel to the
input data, then concatenates the results. This is useful to combine
several feature extraction mechanisms into a single transformer.
Parameters
----------
transformers: list of (name, transformer)
List of transformer objects to be applied to the data.
n_jobs: int, optional
Number of jobs to run in parallel (default 1).
transformer_weights: dict, optional
Multiplicative weights for features per transformer.
Keys are transformer names, values the weights.
"""
def __init__(self, transformer_list, n_jobs=1, transformer_weights=None):
self.transformer_list = transformer_list
self.n_jobs = n_jobs
self.transformer_weights = transformer_weights
def get_feature_names(self):
"""Get feature names from all transformers.
Returns
-------
feature_names : list of strings
Names of the features produced by transform.
"""
feature_names = []
for name, trans in self.transformer_list:
if not hasattr(trans, 'get_feature_names'):
raise AttributeError("Transformer %s does not provide"
" get_feature_names." % str(name))
feature_names.extend([name + "__" + f
for f in trans.get_feature_names()])
return feature_names
def fit(self, X, y=None):
"""Fit all transformers using X.
Parameters
----------
X : array-like or sparse matrix, shape (n_samples, n_features)
Input data, used to fit transformers.
"""
Parallel(n_jobs=self.n_jobs)(delayed(_fit_one_transformer)(trans, X, y)
for name, trans in self.transformer_list)
return self
def transform(self, X):
"""Transform X separately by each transformer, concatenate results.
Parameters
----------
X : array-like or sparse matrix, shape (n_samples, n_features)
Input data to be transformed.
Returns
-------
X_t : array-like or sparse matrix, shape (n_samples, sum_n_components)
hstack of results of transformers. sum_n_components is the
sum of n_components (output dimension) over transformers.
"""
Xs = Parallel(n_jobs=self.n_jobs)(
delayed(_transform_one)(trans, name, X, self.transformer_weights)
for name, trans in self.transformer_list)
if any(sparse.issparse(f) for f in Xs):
Xs = sparse.hstack(Xs).tocsr()
else:
Xs = np.hstack(Xs)
return Xs
def get_params(self, deep=True):
if not deep:
return super(FeatureUnion, self).get_params(deep=False)
else:
out = dict(self.transformer_list)
for name, trans in self.transformer_list:
for key, value in trans.get_params(deep=True).iteritems():
out['%s__%s' % (name, key)] = value
return out