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"""
Testing for grid search module (sklearn.grid_search)
"""
from nose.tools import assert_equal, assert_raises, assert_true
from numpy.testing import assert_array_equal
import numpy as np
import scipy.sparse as sp
from sklearn.base import BaseEstimator
from sklearn.grid_search import GridSearchCV
from sklearn.datasets.samples_generator import make_classification
from sklearn.svm import LinearSVC, SVC
from sklearn.metrics import f1_score, precision_score
class MockClassifier(BaseEstimator):
"""Dummy classifier to test the cross-validation"""
def __init__(self, foo_param=0):
self.foo_param = foo_param
def fit(self, X, Y):
return self
def predict(self, T):
return T.shape[0]
def score(self, X=None, Y=None):
if self.foo_param > 1:
score = 1.
else:
score = 0.
return score
X = np.array([[-1, -1], [-2, -1], [1, 1], [2, 1]])
y = np.array([1, 1, 2, 2])
def test_grid_search():
"""Test that the best estimator contains the right value for foo_param"""
clf = MockClassifier()
grid_search = GridSearchCV(clf, {'foo_param': [1, 2, 3]})
# make sure it selects the smallest parameter in case of ties
grid_search.fit(X, y)
assert_equal(grid_search.best_estimator_.foo_param, 2)
for i, foo_i in enumerate([1, 2, 3]):
assert_true(grid_search.grid_scores_[i][0] == {'foo_param': foo_i})
# Smoke test the score:
grid_search.score(X, y)
def test_no_refit():
"""Test that grid search can be used for model selection only"""
clf = MockClassifier()
grid_search = GridSearchCV(clf, {'foo_param': [1, 2, 3]}, refit=False)
grid_search.fit(X, y)
assert_true(hasattr(grid_search, "best_params_"))
def test_grid_search_error():
"""Test that grid search will capture errors on data with different
length"""
X_, y_ = make_classification(n_samples=200, n_features=100, random_state=0)
clf = LinearSVC()
cv = GridSearchCV(clf, {'C': [0.1, 1.0]})
assert_raises(ValueError, cv.fit, X_[:180], y_)
def test_grid_search_one_grid_point():
X_, y_ = make_classification(n_samples=200, n_features=100, random_state=0)
param_dict = {"C": [1.0], "kernel": ["rbf"], "gamma": [0.1]}
clf = SVC()
cv = GridSearchCV(clf, param_dict)
cv.fit(X_, y_)
clf = SVC(C=1.0, kernel="rbf", gamma=0.1)
clf.fit(X_, y_)
assert_array_equal(clf.dual_coef_, cv.best_estimator_.dual_coef_)
def test_grid_search_bad_param_grid():
param_dict = {"C": 1.0}
clf = SVC()
assert_raises(ValueError, GridSearchCV, clf, param_dict)
param_dict = {"C": []}
clf = SVC()
assert_raises(ValueError, GridSearchCV, clf, param_dict)
param_dict = {"C": np.ones(6).reshape(3, 2)}
clf = SVC()
assert_raises(ValueError, GridSearchCV, clf, param_dict)
def test_grid_search_sparse():
"""Test that grid search works with both dense and sparse matrices"""
X_, y_ = make_classification(n_samples=200, n_features=100, random_state=0)
clf = LinearSVC()
cv = GridSearchCV(clf, {'C': [0.1, 1.0]})
cv.fit(X_[:180], y_[:180])
y_pred = cv.predict(X_[180:])
C = cv.best_estimator_.C
X_ = sp.csr_matrix(X_)
clf = LinearSVC()
cv = GridSearchCV(clf, {'C': [0.1, 1.0]})
cv.fit(X_[:180], y_[:180])
y_pred2 = cv.predict(X_[180:])
C2 = cv.best_estimator_.C
assert_true(np.mean(y_pred == y_pred2) >= .9)
assert_equal(C, C2)
def test_grid_search_sparse_score_func():
X_, y_ = make_classification(n_samples=200, n_features=100, random_state=0)
clf = LinearSVC()
cv = GridSearchCV(clf, {'C': [0.1, 1.0]}, score_func=f1_score)
cv.fit(X_[:180], y_[:180])
y_pred = cv.predict(X_[180:])
C = cv.best_estimator_.C
X_ = sp.csr_matrix(X_)
clf = LinearSVC()
cv = GridSearchCV(clf, {'C': [0.1, 1.0]}, score_func=f1_score)
cv.fit(X_[:180], y_[:180])
y_pred2 = cv.predict(X_[180:])
C2 = cv.best_estimator_.C
assert_array_equal(y_pred, y_pred2)
assert_equal(C, C2)
# Smoke test the score
#np.testing.assert_allclose(f1_score(cv.predict(X_[:180]), y[:180]),
# cv.score(X_[:180], y[:180]))
def test_grid_search_precomputed_kernel():
"""Test that grid search works when the input features are given in the
form of a precomputed kernel matrix """
X_, y_ = make_classification(n_samples=200, n_features=100, random_state=0)
# compute the training kernel matrix corresponding to the linear kernel
K_train = np.dot(X_[:180], X_[:180].T)
y_train = y_[:180]
clf = SVC(kernel='precomputed')
cv = GridSearchCV(clf, {'C': [0.1, 1.0]})
cv.fit(K_train, y_train)
assert_true(cv.best_score_ >= 0)
# compute the test kernel matrix
K_test = np.dot(X_[180:], X_[:180].T)
y_test = y_[180:]
y_pred = cv.predict(K_test)
assert_true(np.mean(y_pred == y_test) >= 0)
def test_grid_search_precomputed_kernel_error_nonsquare():
"""Test that grid search returns an error with a non-square precomputed
training kernel matrix"""
K_train = np.zeros((10, 20))
y_train = np.ones((10, ))
clf = SVC(kernel='precomputed')
cv = GridSearchCV(clf, {'C': [0.1, 1.0]})
assert_raises(ValueError, cv.fit, K_train, y_train)
def test_grid_search_precomputed_kernel_error_kernel_function():
"""Test that grid search returns an error when using a kernel_function"""
X_, y_ = make_classification(n_samples=200, n_features=100, random_state=0)
kernel_function = lambda x1, x2: np.dot(x1, x2.T)
clf = SVC(kernel=kernel_function)
cv = GridSearchCV(clf, {'C': [0.1, 1.0]})
assert_raises(ValueError, cv.fit, X_, y_)
class BrokenClassifier(BaseEstimator):
"""Broken classifier that cannot be fit twice"""
def __init__(self, parameter=None):
self.parameter = parameter
def fit(self, X, y):
assert_true(not hasattr(self, 'has_been_fit_'))
self.has_been_fit_ = True
def predict(self, X):
return np.zeros(X.shape[0])
def test_refit():
"""Regression test for bug in refitting
Simulates re-fitting a broken estimator; this used to break with
sparse SVMs.
"""
X = np.arange(100).reshape(10, 10)
y = np.array([0] * 5 + [1] * 5)
clf = GridSearchCV(BrokenClassifier(), [{'parameter': [0, 1]}],
score_func=precision_score, refit=True)
clf.fit(X, y)
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