sklearn.py 40 KB
Newer Older
wxchan's avatar
wxchan committed
1
# coding: utf-8
2
# pylint: disable = invalid-name, W0105, C0111, C0301
wxchan's avatar
wxchan committed
3
4
"""Scikit-Learn Wrapper interface for LightGBM."""
from __future__ import absolute_import
5

wxchan's avatar
wxchan committed
6
import numpy as np
7
import warnings
8

wxchan's avatar
wxchan committed
9
from .basic import Dataset, LightGBMError
10
from .compat import (SKLEARN_INSTALLED, _LGBMClassifierBase,
11
12
                     LGBMNotFittedError, _LGBMLabelEncoder, _LGBMModelBase,
                     _LGBMRegressorBase, _LGBMCheckXY, _LGBMCheckArray, _LGBMCheckConsistentLength,
13
                     _LGBMCheckClassificationTargets, _LGBMComputeSampleWeight,
14
                     argc_, range_, string_type, DataFrame, LGBMDeprecationWarning)
wxchan's avatar
wxchan committed
15
from .engine import train
16

wxchan's avatar
wxchan committed
17

18
def _objective_function_wrapper(func):
wxchan's avatar
wxchan committed
19
    """Decorate an objective function
20
21
22
23
    Note: for multi-class task, the y_pred is group by class_id first, then group by row_id.
          If you want to get i-th row y_pred in j-th class, the access way is y_pred[j * num_data + i]
          and you should group grad and hess in this way as well.

wxchan's avatar
wxchan committed
24
25
    Parameters
    ----------
Nikita Titov's avatar
Nikita Titov committed
26
    func : callable
27
        Expects a callable with signature ``func(y_true, y_pred)`` or ``func(y_true, y_pred, group):
Nikita Titov's avatar
Nikita Titov committed
28
            y_true : array-like of shape = [n_samples]
29
                The target values.
Nikita Titov's avatar
Nikita Titov committed
30
            y_pred : array-like of shape = [n_samples] or shape = [n_samples * n_classes] (for multi-class)
31
                The predicted values.
Nikita Titov's avatar
Nikita Titov committed
32
            group : array-like
33
                Group/query data, used for ranking task.
wxchan's avatar
wxchan committed
34
35
36

    Returns
    -------
Nikita Titov's avatar
Nikita Titov committed
37
    new_func : callable
wxchan's avatar
wxchan committed
38
39
40
        The new objective function as expected by ``lightgbm.engine.train``.
        The signature is ``new_func(preds, dataset)``:

Nikita Titov's avatar
Nikita Titov committed
41
        preds : array-like of shape = [n_samples] or shape = [n_samples * n_classes]
42
            The predicted values.
Nikita Titov's avatar
Nikita Titov committed
43
        dataset : ``dataset``
wxchan's avatar
wxchan committed
44
            The training set from which the labels will be extracted using
45
            ``dataset.get_label()``.
wxchan's avatar
wxchan committed
46
47
48
49
    """
    def inner(preds, dataset):
        """internal function"""
        labels = dataset.get_label()
wxchan's avatar
wxchan committed
50
        argc = argc_(func)
51
52
53
54
55
        if argc == 2:
            grad, hess = func(labels, preds)
        elif argc == 3:
            grad, hess = func(labels, preds, dataset.get_group())
        else:
wxchan's avatar
wxchan committed
56
            raise TypeError("Self-defined objective function should have 2 or 3 arguments, got %d" % argc)
wxchan's avatar
wxchan committed
57
58
59
60
61
62
63
64
65
66
67
        """weighted for objective"""
        weight = dataset.get_weight()
        if weight is not None:
            """only one class"""
            if len(weight) == len(grad):
                grad = np.multiply(grad, weight)
                hess = np.multiply(hess, weight)
            else:
                num_data = len(weight)
                num_class = len(grad) // num_data
                if num_class * num_data != len(grad):
68
                    raise ValueError("Length of grad and hess should equal to num_class * num_data")
wxchan's avatar
wxchan committed
69
70
                for k in range_(num_class):
                    for i in range_(num_data):
wxchan's avatar
wxchan committed
71
72
73
74
75
76
                        idx = k * num_data + i
                        grad[idx] *= weight[i]
                        hess[idx] *= weight[i]
        return grad, hess
    return inner

wxchan's avatar
wxchan committed
77

78
79
def _eval_function_wrapper(func):
    """Decorate an eval function
80
81
82
    Note: for multi-class task, the y_pred is group by class_id first, then group by row_id.
          If you want to get i-th row y_pred in j-th class, the access way is y_pred[j * num_data + i].

83
84
    Parameters
    ----------
Nikita Titov's avatar
Nikita Titov committed
85
    func : callable
86
87
88
89
90
        Expects a callable with following functions:
            ``func(y_true, y_pred)``,
            ``func(y_true, y_pred, weight)``
         or ``func(y_true, y_pred, weight, group)``
            and return (eval_name->str, eval_result->float, is_bigger_better->Bool):
91

Nikita Titov's avatar
Nikita Titov committed
92
            y_true : array-like of shape = [n_samples]
93
                The target values.
Nikita Titov's avatar
Nikita Titov committed
94
            y_pred : array-like of shape = [n_samples] or shape = [n_samples * n_classes] (for multi-class)
95
                The predicted values.
Nikita Titov's avatar
Nikita Titov committed
96
            weight : array_like of shape = [n_samples]
97
                The weight of samples.
Nikita Titov's avatar
Nikita Titov committed
98
            group : array-like
99
                Group/query data, used for ranking task.
100
101
102

    Returns
    -------
Nikita Titov's avatar
Nikita Titov committed
103
    new_func : callable
104
105
106
        The new eval function as expected by ``lightgbm.engine.train``.
        The signature is ``new_func(preds, dataset)``:

Nikita Titov's avatar
Nikita Titov committed
107
        preds : array-like of shape = [n_samples] or shape = [n_samples * n_classes]
108
            The predicted values.
Nikita Titov's avatar
Nikita Titov committed
109
        dataset : ``dataset``
110
            The training set from which the labels will be extracted using
111
            ``dataset.get_label()``.
112
113
114
115
    """
    def inner(preds, dataset):
        """internal function"""
        labels = dataset.get_label()
wxchan's avatar
wxchan committed
116
        argc = argc_(func)
117
118
119
120
121
122
123
        if argc == 2:
            return func(labels, preds)
        elif argc == 3:
            return func(labels, preds, dataset.get_weight())
        elif argc == 4:
            return func(labels, preds, dataset.get_weight(), dataset.get_group())
        else:
wxchan's avatar
wxchan committed
124
            raise TypeError("Self-defined eval function should have 2, 3 or 4 arguments, got %d" % argc)
125
126
    return inner

wxchan's avatar
wxchan committed
127

128
129
class LGBMModel(_LGBMModelBase):
    """Implementation of the scikit-learn API for LightGBM."""
wxchan's avatar
wxchan committed
130

131
    def __init__(self, boosting_type="gbdt", num_leaves=31, max_depth=-1,
132
                 learning_rate=0.1, n_estimators=100,
133
                 subsample_for_bin=200000, objective=None, class_weight=None,
134
                 min_split_gain=0., min_child_weight=1e-3, min_child_samples=20,
135
                 subsample=1., subsample_freq=0, colsample_bytree=1.,
136
                 reg_alpha=0., reg_lambda=0., random_state=None,
137
                 n_jobs=-1, silent=True, importance_type='split', **kwargs):
138
        """Construct a gradient boosting model.
wxchan's avatar
wxchan committed
139
140
141

        Parameters
        ----------
142
143
144
145
146
147
        boosting_type : string, optional (default="gbdt")
            'gbdt', traditional Gradient Boosting Decision Tree.
            'dart', Dropouts meet Multiple Additive Regression Trees.
            'goss', Gradient-based One-Side Sampling.
            'rf', Random Forest.
        num_leaves : int, optional (default=31)
wxchan's avatar
wxchan committed
148
            Maximum tree leaves for base learners.
149
        max_depth : int, optional (default=-1)
wxchan's avatar
wxchan committed
150
            Maximum tree depth for base learners, -1 means no limit.
151
        learning_rate : float, optional (default=0.1)
152
            Boosting learning rate.
153
154
155
            You can use ``callbacks`` parameter of ``fit`` method to shrink/adapt learning rate
            in training using ``reset_parameter`` callback.
            Note, that this will ignore the ``learning_rate`` argument in training.
156
        n_estimators : int, optional (default=100)
wxchan's avatar
wxchan committed
157
            Number of boosted trees to fit.
158
        subsample_for_bin : int, optional (default=50000)
wxchan's avatar
wxchan committed
159
            Number of samples for constructing bins.
160
        objective : string, callable or None, optional (default=None)
wxchan's avatar
wxchan committed
161
162
            Specify the learning task and the corresponding learning objective or
            a custom objective function to be used (see note below).
163
            Default: 'regression' for LGBMRegressor, 'binary' or 'multiclass' for LGBMClassifier, 'lambdarank' for LGBMRanker.
164
165
166
167
168
169
170
171
172
        class_weight : dict, 'balanced' or None, optional (default=None)
            Weights associated with classes in the form ``{class_label: weight}``.
            Use this parameter only for multi-class classification task;
            for binary classification task you may use ``is_unbalance`` or ``scale_pos_weight`` parameters.
            The 'balanced' mode uses the values of y to automatically adjust weights
            inversely proportional to class frequencies in the input data as ``n_samples / (n_classes * np.bincount(y))``.
            If None, all classes are supposed to have weight one.
            Note that these weights will be multiplied with ``sample_weight`` (passed through the fit method)
            if ``sample_weight`` is specified.
173
        min_split_gain : float, optional (default=0.)
wxchan's avatar
wxchan committed
174
            Minimum loss reduction required to make a further partition on a leaf node of the tree.
175
        min_child_weight : float, optional (default=1e-3)
176
            Minimum sum of instance weight(hessian) needed in a child(leaf).
177
        min_child_samples : int, optional (default=20)
178
            Minimum number of data need in a child(leaf).
179
        subsample : float, optional (default=1.)
wxchan's avatar
wxchan committed
180
            Subsample ratio of the training instance.
181
        subsample_freq : int, optional (default=0)
182
183
            Frequence of subsample, <=0 means no enable.
        colsample_bytree : float, optional (default=1.)
wxchan's avatar
wxchan committed
184
            Subsample ratio of columns when constructing each tree.
185
        reg_alpha : float, optional (default=0.)
186
            L1 regularization term on weights.
187
        reg_lambda : float, optional (default=0.)
188
            L2 regularization term on weights.
189
        random_state : int or None, optional (default=None)
wxchan's avatar
wxchan committed
190
            Random number seed.
191
            If None, default seeds in C++ code will be used.
192
        n_jobs : int, optional (default=-1)
193
            Number of parallel threads.
194
        silent : bool, optional (default=True)
wxchan's avatar
wxchan committed
195
            Whether to print messages while running boosting.
196
        importance_type : string, optional (default='split')
197
198
199
            The type of feature importance to be filled into ``feature_importances_``.
            If "split", result contains numbers of times the feature is used in a model.
            If "gain", result contains total gains of splits which use the feature.
wxchan's avatar
wxchan committed
200
201
        **kwargs : other parameters
            Check http://lightgbm.readthedocs.io/en/latest/Parameters.html for more parameters.
202
203
204

            Note
            ----
205
            \\*\\*kwargs is not supported in sklearn, it may cause unexpected issues.
wxchan's avatar
wxchan committed
206

207
208
209
210
211
212
213
214
215
        Attributes
        ----------
        n_features_ : int
            The number of features of fitted model.
        classes_ : array of shape = [n_classes]
            The class label array (only for classification problem).
        n_classes_ : int
            The number of classes (only for classification problem).
        best_score_ : dict or None
216
            The best score of fitted model.
217
        best_iteration_ : int or None
218
            The best iteration of fitted model if ``early_stopping_rounds`` has been specified.
219
220
221
222
223
        objective_ : string or callable
            The concrete objective used while fitting this model.
        booster_ : Booster
            The underlying Booster of this model.
        evals_result_ : dict or None
224
            The evaluation results if ``early_stopping_rounds`` has been specified.
225
226
227
        feature_importances_ : array of shape = [n_features]
            The feature importances (the higher, the more important the feature).

wxchan's avatar
wxchan committed
228
229
230
231
        Note
        ----
        A custom objective function can be provided for the ``objective``
        parameter. In this case, it should have the signature
232
233
        ``objective(y_true, y_pred) -> grad, hess`` or
        ``objective(y_true, y_pred, group) -> grad, hess``:
wxchan's avatar
wxchan committed
234

Nikita Titov's avatar
Nikita Titov committed
235
            y_true : array-like of shape = [n_samples]
236
                The target values.
Nikita Titov's avatar
Nikita Titov committed
237
            y_pred : array-like of shape = [n_samples] or shape = [n_samples * n_classes] (for multi-class task)
238
                The predicted values.
Nikita Titov's avatar
Nikita Titov committed
239
            group : array-like
240
                Group/query data, used for ranking task.
Nikita Titov's avatar
Nikita Titov committed
241
            grad : array-like of shape = [n_samples] or shape = [n_samples * n_classes] (for multi-class task)
wxchan's avatar
wxchan committed
242
                The value of the gradient for each sample point.
Nikita Titov's avatar
Nikita Titov committed
243
            hess : array-like of shape = [n_samples] or shape = [n_samples * n_classes] (for multi-class task)
244
                The value of the second derivative for each sample point.
wxchan's avatar
wxchan committed
245

246
247
248
        For multi-class task, the y_pred is group by class_id first, then group by row_id.
        If you want to get i-th row y_pred in j-th class, the access way is y_pred[j * num_data + i]
        and you should group grad and hess in this way as well.
wxchan's avatar
wxchan committed
249
        """
wxchan's avatar
wxchan committed
250
        if not SKLEARN_INSTALLED:
251
            raise LightGBMError('Scikit-learn is required for this module')
wxchan's avatar
wxchan committed
252

253
        self.boosting_type = boosting_type
254
        self.objective = objective
wxchan's avatar
wxchan committed
255
256
257
258
        self.num_leaves = num_leaves
        self.max_depth = max_depth
        self.learning_rate = learning_rate
        self.n_estimators = n_estimators
wxchan's avatar
wxchan committed
259
        self.subsample_for_bin = subsample_for_bin
wxchan's avatar
wxchan committed
260
261
262
263
264
265
266
267
        self.min_split_gain = min_split_gain
        self.min_child_weight = min_child_weight
        self.min_child_samples = min_child_samples
        self.subsample = subsample
        self.subsample_freq = subsample_freq
        self.colsample_bytree = colsample_bytree
        self.reg_alpha = reg_alpha
        self.reg_lambda = reg_lambda
268
269
        self.random_state = random_state
        self.n_jobs = n_jobs
wxchan's avatar
wxchan committed
270
        self.silent = silent
271
        self.importance_type = importance_type
wxchan's avatar
wxchan committed
272
        self._Booster = None
273
274
275
276
        self._evals_result = None
        self._best_score = None
        self._best_iteration = None
        self._other_params = {}
277
        self._objective = objective
278
        self.class_weight = class_weight
279
280
281
        self._n_features = None
        self._classes = None
        self._n_classes = None
282
        self.set_params(**kwargs)
wxchan's avatar
wxchan committed
283
284
285

    def get_params(self, deep=True):
        params = super(LGBMModel, self).get_params(deep=deep)
286
        params.update(self._other_params)
wxchan's avatar
wxchan committed
287
288
289
290
291
292
        return params

    # minor change to support `**kwargs`
    def set_params(self, **params):
        for key, value in params.items():
            setattr(self, key, value)
293
294
            if hasattr(self, '_' + key):
                setattr(self, '_' + key, value)
295
            self._other_params[key] = value
wxchan's avatar
wxchan committed
296
        return self
wxchan's avatar
wxchan committed
297

Guolin Ke's avatar
Guolin Ke committed
298
    def fit(self, X, y,
299
            sample_weight=None, init_score=None, group=None,
300
            eval_set=None, eval_names=None, eval_sample_weight=None,
301
302
303
            eval_class_weight=None, eval_init_score=None, eval_group=None,
            eval_metric=None, early_stopping_rounds=None, verbose=True,
            feature_name='auto', categorical_feature='auto', callbacks=None):
304
        """Build a gradient boosting model from the training set (X, y).
wxchan's avatar
wxchan committed
305
306
307

        Parameters
        ----------
308
309
310
311
312
313
314
315
        X : array-like or sparse matrix of shape = [n_samples, n_features]
            Input feature matrix.
        y : array-like of shape = [n_samples]
            The target values (class labels in classification, real numbers in regression).
        sample_weight : array-like of shape = [n_samples] or None, optional (default=None)
            Weights of training data.
        init_score : array-like of shape = [n_samples] or None, optional (default=None)
            Init score of training data.
316
        group : array-like or None, optional (default=None)
317
318
            Group data of training data.
        eval_set : list or None, optional (default=None)
319
            A list of (X, y) tuple pairs to use as a validation sets.
320
        eval_names : list of strings or None, optional (default=None)
321
322
323
            Names of eval_set.
        eval_sample_weight : list of arrays or None, optional (default=None)
            Weights of eval data.
324
325
        eval_class_weight : list or None, optional (default=None)
            Class weights of eval data.
326
327
328
329
330
331
        eval_init_score : list of arrays or None, optional (default=None)
            Init score of eval data.
        eval_group : list of arrays or None, optional (default=None)
            Group data of eval data.
        eval_metric : string, list of strings, callable or None, optional (default=None)
            If string, it should be a built-in evaluation metric to use.
332
            If callable, it should be a custom evaluation metric, see note below for more details.
Misha Lisovyi's avatar
Misha Lisovyi committed
333
            In either case, the ``metric`` from the model parameters will be evaluated and used as well.
334
            Default: 'l2' for LGBMRegressor, 'logloss' for LGBMClassifier, 'ndcg' for LGBMRanker.
335
336
        early_stopping_rounds : int or None, optional (default=None)
            Activates early stopping. The model will train until the validation score stops improving.
337
            Validation score needs to improve at least every ``early_stopping_rounds`` round(s)
338
            to continue training.
339
340
            Requires at least one validation data and one metric.
            If there's more than one, will check all of them. But the training data is ignored anyway.
341
342
343
344
345
346
347
348
        verbose : bool, optional (default=True)
            If True and an evaluation set is used, writes the evaluation progress.
        feature_name : list of strings or 'auto', optional (default="auto")
            Feature names.
            If 'auto' and data is pandas DataFrame, data columns names are used.
        categorical_feature : list of strings or int, or 'auto', optional (default="auto")
            Categorical features.
            If list of int, interpreted as indices.
349
            If list of strings, interpreted as feature names (need to specify ``feature_name`` as well).
350
            If 'auto' and data is pandas DataFrame, pandas categorical columns are used.
351
352
            All values in categorical features should be less than int32 max value (2147483647).
            All negative values in categorical features will be treated as missing values.
353
        callbacks : list of callback functions or None, optional (default=None)
354
            List of callback functions that are applied at each iteration.
355
            See Callbacks in Python API for more information.
356

357
358
359
360
361
        Returns
        -------
        self : object
            Returns self.

362
363
        Note
        ----
wxchan's avatar
wxchan committed
364
        Custom eval function expects a callable with following functions:
365
366
367
368
369
        ``func(y_true, y_pred)``, ``func(y_true, y_pred, weight)`` or
        ``func(y_true, y_pred, weight, group)``.
        Returns (eval_name, eval_result, is_bigger_better) or
        list of (eval_name, eval_result, is_bigger_better)

Nikita Titov's avatar
Nikita Titov committed
370
            y_true : array-like of shape = [n_samples]
371
                The target values.
Nikita Titov's avatar
Nikita Titov committed
372
            y_pred : array-like of shape = [n_samples] or shape = [n_samples * n_classes] (for multi-class)
373
                The predicted values.
Nikita Titov's avatar
Nikita Titov committed
374
            weight : array-like of shape = [n_samples]
375
                The weight of samples.
Nikita Titov's avatar
Nikita Titov committed
376
            group : array-like
377
                Group/query data, used for ranking task.
Nikita Titov's avatar
Nikita Titov committed
378
            eval_name : string
379
                The name of evaluation.
Nikita Titov's avatar
Nikita Titov committed
380
            eval_result : float
381
                The eval result.
Nikita Titov's avatar
Nikita Titov committed
382
            is_bigger_better : bool
383
                Is eval result bigger better, e.g. AUC is bigger_better.
384

385
386
        For multi-class task, the y_pred is group by class_id first, then group by row_id.
        If you want to get i-th row y_pred in j-th class, the access way is y_pred[j * num_data + i].
wxchan's avatar
wxchan committed
387
        """
388
389
390
391
392
393
394
395
396
397
398
399
400
        if self._objective is None:
            if isinstance(self, LGBMRegressor):
                self._objective = "regression"
            elif isinstance(self, LGBMClassifier):
                self._objective = "binary"
            elif isinstance(self, LGBMRanker):
                self._objective = "lambdarank"
            else:
                raise ValueError("Unknown LGBMModel type.")
        if callable(self._objective):
            self._fobj = _objective_function_wrapper(self._objective)
        else:
            self._fobj = None
wxchan's avatar
wxchan committed
401
402
        evals_result = {}
        params = self.get_params()
wxchan's avatar
wxchan committed
403
        # user can set verbose with kwargs, it has higher priority
404
        if not any(verbose_alias in params for verbose_alias in ('verbose', 'verbosity')) and self.silent:
405
            params['verbose'] = 0
wxchan's avatar
wxchan committed
406
        params.pop('silent', None)
407
        params.pop('importance_type', None)
wxchan's avatar
wxchan committed
408
        params.pop('n_estimators', None)
409
        params.pop('class_weight', None)
410
411
412
        if self._n_classes is not None and self._n_classes > 2:
            params['num_class'] = self._n_classes
        if hasattr(self, '_eval_at'):
413
            params['eval_at'] = self._eval_at
414
415
        params['objective'] = self._objective
        if self._fobj:
wxchan's avatar
wxchan committed
416
            params['objective'] = 'None'  # objective = nullptr for unknown objective
wxchan's avatar
wxchan committed
417
418

        if callable(eval_metric):
419
            feval = _eval_function_wrapper(eval_metric)
wxchan's avatar
wxchan committed
420
421
        else:
            feval = None
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
            # register default metric for consistency with callable eval_metric case
            original_metric = self._objective if isinstance(self._objective, string_type) else None
            if original_metric is None:
                # try to deduce from class instance
                if isinstance(self, LGBMRegressor):
                    original_metric = "l2"
                elif isinstance(self, LGBMClassifier):
                    original_metric = "multi_logloss" if self._n_classes > 2 else "binary_logloss"
                elif isinstance(self, LGBMRanker):
                    original_metric = "ndcg"
            # overwrite default metric by explicitly set metric
            for metric_alias in ['metric', 'metrics', 'metric_types']:
                if metric_alias in params:
                    original_metric = params.pop(metric_alias)
            # concatenate metric from params (or default if not provided in params) and eval_metric
            original_metric = [original_metric] if isinstance(original_metric, (string_type, type(None))) else original_metric
            eval_metric = [eval_metric] if isinstance(eval_metric, (string_type, type(None))) else eval_metric
            params['metric'] = set(original_metric + eval_metric)
wxchan's avatar
wxchan committed
440

Nikita Titov's avatar
Nikita Titov committed
441
        if not isinstance(X, DataFrame):
442
443
444
            X, y = _LGBMCheckXY(X, y, accept_sparse=True, force_all_finite=False, ensure_min_samples=2)
            _LGBMCheckConsistentLength(X, y, sample_weight)

445
446
447
448
449
450
        if self.class_weight is not None:
            class_sample_weight = _LGBMComputeSampleWeight(self.class_weight, y)
            if sample_weight is None or len(sample_weight) == 0:
                sample_weight = class_sample_weight
            else:
                sample_weight = np.multiply(sample_weight, class_sample_weight)
451

452
453
        self._n_features = X.shape[1]

Guolin Ke's avatar
Guolin Ke committed
454
        def _construct_dataset(X, y, sample_weight, init_score, group, params):
455
            ret = Dataset(X, label=y, weight=sample_weight, group=group, params=params)
Nikita Titov's avatar
Nikita Titov committed
456
            return ret.set_init_score(init_score)
Guolin Ke's avatar
Guolin Ke committed
457

Guolin Ke's avatar
Guolin Ke committed
458
        train_set = _construct_dataset(X, y, sample_weight, init_score, group, params)
Guolin Ke's avatar
Guolin Ke committed
459
460
461

        valid_sets = []
        if eval_set is not None:
462
463
464
465
466
467
468
469
470
471
472

            def _get_meta_data(collection, i):
                if collection is None:
                    return None
                elif isinstance(collection, list):
                    return collection[i] if len(collection) > i else None
                elif isinstance(collection, dict):
                    return collection.get(i, None)
                else:
                    raise TypeError('eval_sample_weight, eval_class_weight, eval_init_score, and eval_group should be dict or list')

Guolin Ke's avatar
Guolin Ke committed
473
474
475
            if isinstance(eval_set, tuple):
                eval_set = [eval_set]
            for i, valid_data in enumerate(eval_set):
476
                # reduce cost for prediction training data
Guolin Ke's avatar
Guolin Ke committed
477
478
479
                if valid_data[0] is X and valid_data[1] is y:
                    valid_set = train_set
                else:
480
481
482
                    valid_weight = _get_meta_data(eval_sample_weight, i)
                    if _get_meta_data(eval_class_weight, i) is not None:
                        valid_class_sample_weight = _LGBMComputeSampleWeight(_get_meta_data(eval_class_weight, i), valid_data[1])
483
484
485
486
                        if valid_weight is None or len(valid_weight) == 0:
                            valid_weight = valid_class_sample_weight
                        else:
                            valid_weight = np.multiply(valid_weight, valid_class_sample_weight)
487
488
                    valid_init_score = _get_meta_data(eval_init_score, i)
                    valid_group = _get_meta_data(eval_group, i)
Guolin Ke's avatar
Guolin Ke committed
489
                    valid_set = _construct_dataset(valid_data[0], valid_data[1], valid_weight, valid_init_score, valid_group, params)
Guolin Ke's avatar
Guolin Ke committed
490
491
492
                valid_sets.append(valid_set)

        self._Booster = train(params, train_set,
493
                              self.n_estimators, valid_sets=valid_sets, valid_names=eval_names,
wxchan's avatar
wxchan committed
494
                              early_stopping_rounds=early_stopping_rounds,
495
                              evals_result=evals_result, fobj=self._fobj, feval=feval,
Guolin Ke's avatar
Guolin Ke committed
496
                              verbose_eval=verbose, feature_name=feature_name,
497
                              categorical_feature=categorical_feature,
498
                              callbacks=callbacks)
wxchan's avatar
wxchan committed
499
500

        if evals_result:
501
            self._evals_result = evals_result
wxchan's avatar
wxchan committed
502
503

        if early_stopping_rounds is not None:
504
            self._best_iteration = self._Booster.best_iteration
505
506

        self._best_score = self._Booster.best_score
wxchan's avatar
wxchan committed
507
508
509
510

        # free dataset
        self.booster_.free_dataset()
        del train_set, valid_sets
wxchan's avatar
wxchan committed
511
512
        return self

513
    def predict(self, X, raw_score=False, num_iteration=None,
514
                pred_leaf=False, pred_contrib=False, **kwargs):
515
        """Return the predicted value for each sample.
wxchan's avatar
wxchan committed
516
517
518

        Parameters
        ----------
519
        X : array-like or sparse matrix of shape = [n_samples, n_features]
wxchan's avatar
wxchan committed
520
            Input features matrix.
521
522
        raw_score : bool, optional (default=False)
            Whether to predict raw scores.
523
        num_iteration : int or None, optional (default=None)
524
            Limit number of iterations in the prediction.
525
526
            If None, if the best iteration exists, it is used; otherwise, all trees are used.
            If <= 0, all trees are used (no limits).
527
528
529
530
        pred_leaf : bool, optional (default=False)
            Whether to predict leaf index.
        pred_contrib : bool, optional (default=False)
            Whether to predict feature contributions.
531
532
533
534
535
536
537

            Note
            ----
            If you want to get more explanation for your model's predictions using SHAP values
            like SHAP interaction values,
            you can install shap package (https://github.com/slundberg/shap).

538
        **kwargs : other parameters for the prediction
wxchan's avatar
wxchan committed
539
540
541

        Returns
        -------
542
543
        predicted_result : array-like of shape = [n_samples] or shape = [n_samples, n_classes]
            The predicted values.
544
545
546
547
        X_leaves : array-like of shape = [n_samples, n_trees] or shape [n_samples, n_trees * n_classes]
            If ``pred_leaf=True``, the predicted leaf every tree for each sample.
        X_SHAP_values : array-like of shape = [n_samples, n_features + 1] or shape [n_samples, (n_features + 1) * n_classes]
            If ``pred_contrib=True``, the each feature contributions for each sample.
wxchan's avatar
wxchan committed
548
        """
549
550
        if self._n_features is None:
            raise LGBMNotFittedError("Estimator not fitted, call `fit` before exploiting the model.")
Nikita Titov's avatar
Nikita Titov committed
551
        if not isinstance(X, DataFrame):
552
            X = _LGBMCheckArray(X, accept_sparse=True, force_all_finite=False)
553
554
555
556
557
558
        n_features = X.shape[1]
        if self._n_features != n_features:
            raise ValueError("Number of features of the model must "
                             "match the input. Model n_features_ is %s and "
                             "input n_features is %s "
                             % (self._n_features, n_features))
559
560
        return self.booster_.predict(X, raw_score=raw_score, num_iteration=num_iteration,
                                     pred_leaf=pred_leaf, pred_contrib=pred_contrib, **kwargs)
wxchan's avatar
wxchan committed
561
562

    def apply(self, X, num_iteration=0):
563
        """Return the predicted leaf every tree for each sample.
wxchan's avatar
wxchan committed
564
565
566

        Parameters
        ----------
567
        X : array-like or sparse matrix of shape = [n_samples, n_features]
wxchan's avatar
wxchan committed
568
            Input features matrix.
569
        num_iteration : int, optional (default=0)
wxchan's avatar
wxchan committed
570
            Limit number of iterations in the prediction; defaults to 0 (use all trees).
wxchan's avatar
wxchan committed
571
572
573

        Returns
        -------
574
575
        X_leaves : array-like of shape = [n_samples, n_trees]
            The predicted leaf every tree for each sample.
wxchan's avatar
wxchan committed
576
        """
577
578
579
        warnings.warn('apply method is deprecated and will be removed in 2.2 version.\n'
                      'Please use pred_leaf parameter of predict method instead.',
                      LGBMDeprecationWarning)
580
581
        if self._n_features is None:
            raise LGBMNotFittedError("Estimator not fitted, call `fit` before exploiting the model.")
Nikita Titov's avatar
Nikita Titov committed
582
        if not isinstance(X, DataFrame):
583
            X = _LGBMCheckArray(X, accept_sparse=True, force_all_finite=False)
584
585
586
587
588
589
        n_features = X.shape[1]
        if self._n_features != n_features:
            raise ValueError("Number of features of the model must "
                             "match the input. Model n_features_ is %s and "
                             "input n_features is %s "
                             % (self._n_features, n_features))
590
        return self.booster_.predict(X, pred_leaf=True, num_iteration=num_iteration)
wxchan's avatar
wxchan committed
591

592
593
594
595
596
597
598
599
600
601
602
603
604
605
606
607
608
609
610
611
612
613
614
615
616
617
618
619
    @property
    def n_features_(self):
        """Get the number of features of fitted model."""
        if self._n_features is None:
            raise LGBMNotFittedError('No n_features found. Need to call fit beforehand.')
        return self._n_features

    @property
    def best_score_(self):
        """Get the best score of fitted model."""
        if self._n_features is None:
            raise LGBMNotFittedError('No best_score found. Need to call fit beforehand.')
        return self._best_score

    @property
    def best_iteration_(self):
        """Get the best iteration of fitted model."""
        if self._n_features is None:
            raise LGBMNotFittedError('No best_iteration found. Need to call fit with early_stopping_rounds beforehand.')
        return self._best_iteration

    @property
    def objective_(self):
        """Get the concrete objective used while fitting this model."""
        if self._n_features is None:
            raise LGBMNotFittedError('No objective found. Need to call fit beforehand.')
        return self._objective

620
621
622
623
    @property
    def booster_(self):
        """Get the underlying lightgbm Booster of this model."""
        if self._Booster is None:
624
            raise LGBMNotFittedError('No booster found. Need to call fit beforehand.')
625
        return self._Booster
wxchan's avatar
wxchan committed
626

627
628
629
    @property
    def evals_result_(self):
        """Get the evaluation results."""
630
631
632
        if self._n_features is None:
            raise LGBMNotFittedError('No results found. Need to call fit with eval_set beforehand.')
        return self._evals_result
633
634

    @property
635
    def feature_importances_(self):
636
        """Get feature importances.
637

638
639
640
        Note
        ----
        Feature importance in sklearn interface used to normalize to 1,
641
642
643
        it's deprecated after 2.0.4 and is the same as Booster.feature_importance() now.
        ``importance_type`` attribute is passed to the function
        to configure the type of importance values to be extracted.
644
        """
645
646
        if self._n_features is None:
            raise LGBMNotFittedError('No feature_importances found. Need to call fit beforehand.')
647
        return self.booster_.feature_importance(importance_type=self.importance_type)
wxchan's avatar
wxchan committed
648

wxchan's avatar
wxchan committed
649

650
651
class LGBMRegressor(LGBMModel, _LGBMRegressorBase):
    """LightGBM regressor."""
wxchan's avatar
wxchan committed
652

Guolin Ke's avatar
Guolin Ke committed
653
654
    def fit(self, X, y,
            sample_weight=None, init_score=None,
655
            eval_set=None, eval_names=None, eval_sample_weight=None,
656
            eval_init_score=None, eval_metric=None, early_stopping_rounds=None,
657
            verbose=True, feature_name='auto', categorical_feature='auto', callbacks=None):
658
659
660

        super(LGBMRegressor, self).fit(X, y, sample_weight=sample_weight,
                                       init_score=init_score, eval_set=eval_set,
661
                                       eval_names=eval_names,
662
663
664
665
666
                                       eval_sample_weight=eval_sample_weight,
                                       eval_init_score=eval_init_score,
                                       eval_metric=eval_metric,
                                       early_stopping_rounds=early_stopping_rounds,
                                       verbose=verbose, feature_name=feature_name,
667
                                       categorical_feature=categorical_feature,
Guolin Ke's avatar
Guolin Ke committed
668
                                       callbacks=callbacks)
Guolin Ke's avatar
Guolin Ke committed
669
670
        return self

671
672
673
    _base_doc = LGBMModel.fit.__doc__
    fit.__doc__ = (_base_doc[:_base_doc.find('eval_class_weight :')]
                   + _base_doc[_base_doc.find('eval_init_score :'):])
wxchan's avatar
wxchan committed
674

675
676
677

class LGBMClassifier(LGBMModel, _LGBMClassifierBase):
    """LightGBM classifier."""
wxchan's avatar
wxchan committed
678

Guolin Ke's avatar
Guolin Ke committed
679
680
    def fit(self, X, y,
            sample_weight=None, init_score=None,
681
            eval_set=None, eval_names=None, eval_sample_weight=None,
682
            eval_class_weight=None, eval_init_score=None, eval_metric=None,
wxchan's avatar
wxchan committed
683
            early_stopping_rounds=None, verbose=True,
684
685
686
            feature_name='auto', categorical_feature='auto', callbacks=None):
        _LGBMCheckClassificationTargets(y)
        self._le = _LGBMLabelEncoder().fit(y)
687
        _y = self._le.transform(y)
688

689
690
691
        self._classes = self._le.classes_
        self._n_classes = len(self._classes)
        if self._n_classes > 2:
wxchan's avatar
wxchan committed
692
            # Switch to using a multiclass objective in the underlying LGBM instance
693
694
            ova_aliases = ("multiclassova", "multiclass_ova", "ova", "ovr")
            if self._objective not in ova_aliases and not callable(self._objective):
695
                self._objective = "multiclass"
696
            if eval_metric in ('logloss', 'binary_logloss'):
wxchan's avatar
wxchan committed
697
                eval_metric = "multi_logloss"
698
            elif eval_metric in ('error', 'binary_error'):
wxchan's avatar
wxchan committed
699
700
                eval_metric = "multi_error"
        else:
701
            if eval_metric in ('logloss', 'multi_logloss'):
wxchan's avatar
wxchan committed
702
                eval_metric = 'binary_logloss'
703
            elif eval_metric in ('error', 'multi_error'):
wxchan's avatar
wxchan committed
704
                eval_metric = 'binary_error'
wxchan's avatar
wxchan committed
705
706

        if eval_set is not None:
707
708
709
710
711
712
713
            if isinstance(eval_set, tuple):
                eval_set = [eval_set]
            for i, (valid_x, valid_y) in enumerate(eval_set):
                if valid_x is X and valid_y is y:
                    eval_set[i] = (valid_x, _y)
                else:
                    eval_set[i] = (valid_x, self._le.transform(valid_y))
714

715
        super(LGBMClassifier, self).fit(X, _y, sample_weight=sample_weight,
716
                                        init_score=init_score, eval_set=eval_set,
717
                                        eval_names=eval_names,
718
                                        eval_sample_weight=eval_sample_weight,
719
                                        eval_class_weight=eval_class_weight,
720
721
722
723
                                        eval_init_score=eval_init_score,
                                        eval_metric=eval_metric,
                                        early_stopping_rounds=early_stopping_rounds,
                                        verbose=verbose, feature_name=feature_name,
724
                                        categorical_feature=categorical_feature,
725
                                        callbacks=callbacks)
wxchan's avatar
wxchan committed
726
727
        return self

728
    fit.__doc__ = LGBMModel.fit.__doc__
729

730
    def predict(self, X, raw_score=False, num_iteration=None,
731
732
733
734
735
736
737
738
                pred_leaf=False, pred_contrib=False, **kwargs):
        result = self.predict_proba(X, raw_score, num_iteration,
                                    pred_leaf, pred_contrib, **kwargs)
        if raw_score or pred_leaf or pred_contrib:
            return result
        else:
            class_index = np.argmax(result, axis=1)
            return self._le.inverse_transform(class_index)
wxchan's avatar
wxchan committed
739

740
741
    predict.__doc__ = LGBMModel.predict.__doc__

742
    def predict_proba(self, X, raw_score=False, num_iteration=None,
743
                      pred_leaf=False, pred_contrib=False, **kwargs):
744
        """Return the predicted probability for each class for each sample.
wxchan's avatar
wxchan committed
745
746
747

        Parameters
        ----------
748
        X : array-like or sparse matrix of shape = [n_samples, n_features]
wxchan's avatar
wxchan committed
749
            Input features matrix.
750
751
        raw_score : bool, optional (default=False)
            Whether to predict raw scores.
752
        num_iteration : int or None, optional (default=None)
753
            Limit number of iterations in the prediction.
754
755
            If None, if the best iteration exists, it is used; otherwise, all trees are used.
            If <= 0, all trees are used (no limits).
756
757
758
759
        pred_leaf : bool, optional (default=False)
            Whether to predict leaf index.
        pred_contrib : bool, optional (default=False)
            Whether to predict feature contributions.
760
761
762
763
764
765
766

            Note
            ----
            If you want to get more explanation for your model's predictions using SHAP values
            like SHAP interaction values,
            you can install shap package (https://github.com/slundberg/shap).

767
        **kwargs : other parameters for the prediction
wxchan's avatar
wxchan committed
768
769
770

        Returns
        -------
771
772
        predicted_probability : array-like of shape = [n_samples, n_classes]
            The predicted probability for each class for each sample.
773
774
775
776
        X_leaves : array-like of shape = [n_samples, n_trees * n_classes]
            If ``pred_leaf=True``, the predicted leaf every tree for each sample.
        X_SHAP_values : array-like of shape = [n_samples, (n_features + 1) * n_classes]
            If ``pred_contrib=True``, the each feature contributions for each sample.
wxchan's avatar
wxchan committed
777
        """
778
779
780
781
        result = super(LGBMClassifier, self).predict(X, raw_score, num_iteration,
                                                     pred_leaf, pred_contrib, **kwargs)
        if self._n_classes > 2 or pred_leaf or pred_contrib:
            return result
wxchan's avatar
wxchan committed
782
        else:
783
            return np.vstack((1. - result, result)).transpose()
784
785
786

    @property
    def classes_(self):
787
788
789
790
        """Get the class label array."""
        if self._classes is None:
            raise LGBMNotFittedError('No classes found. Need to call fit beforehand.')
        return self._classes
791
792
793

    @property
    def n_classes_(self):
794
795
796
797
        """Get the number of classes."""
        if self._n_classes is None:
            raise LGBMNotFittedError('No classes found. Need to call fit beforehand.')
        return self._n_classes
wxchan's avatar
wxchan committed
798

wxchan's avatar
wxchan committed
799

wxchan's avatar
wxchan committed
800
class LGBMRanker(LGBMModel):
801
    """LightGBM ranker."""
wxchan's avatar
wxchan committed
802

Guolin Ke's avatar
Guolin Ke committed
803
    def fit(self, X, y,
804
            sample_weight=None, init_score=None, group=None,
805
            eval_set=None, eval_names=None, eval_sample_weight=None,
806
            eval_init_score=None, eval_group=None, eval_metric=None,
807
808
809
            eval_at=[1], early_stopping_rounds=None, verbose=True,
            feature_name='auto', categorical_feature='auto', callbacks=None):
        # check group data
Guolin Ke's avatar
Guolin Ke committed
810
        if group is None:
811
            raise ValueError("Should set group for ranking task")
wxchan's avatar
wxchan committed
812
813

        if eval_set is not None:
Guolin Ke's avatar
Guolin Ke committed
814
            if eval_group is None:
815
                raise ValueError("Eval_group cannot be None when eval_set is not None")
Guolin Ke's avatar
Guolin Ke committed
816
            elif len(eval_group) != len(eval_set):
817
                raise ValueError("Length of eval_group should be equal to eval_set")
wxchan's avatar
wxchan committed
818
            elif (isinstance(eval_group, dict) and any(i not in eval_group or eval_group[i] is None for i in range_(len(eval_group)))) \
wxchan's avatar
wxchan committed
819
                    or (isinstance(eval_group, list) and any(group is None for group in eval_group)):
820
821
                raise ValueError("Should set group for all eval datasets for ranking task; "
                                 "if you use dict, the index should start from 0")
822

823
        self._eval_at = eval_at
824
825
        super(LGBMRanker, self).fit(X, y, sample_weight=sample_weight,
                                    init_score=init_score, group=group,
826
827
                                    eval_set=eval_set, eval_names=eval_names,
                                    eval_sample_weight=eval_sample_weight,
828
829
830
831
                                    eval_init_score=eval_init_score, eval_group=eval_group,
                                    eval_metric=eval_metric,
                                    early_stopping_rounds=early_stopping_rounds,
                                    verbose=verbose, feature_name=feature_name,
832
                                    categorical_feature=categorical_feature,
833
                                    callbacks=callbacks)
wxchan's avatar
wxchan committed
834
        return self
835

836
837
838
839
    _base_doc = LGBMModel.fit.__doc__
    fit.__doc__ = (_base_doc[:_base_doc.find('eval_class_weight :')]
                   + _base_doc[_base_doc.find('eval_init_score :'):])
    _base_doc = fit.__doc__
840
841
    _before_early_stop, _early_stop, _after_early_stop = _base_doc.partition('early_stopping_rounds :')
    fit.__doc__ = (_before_early_stop
842
                   + 'eval_at : list of int, optional (default=[1])\n'
843
844
                   + ' ' * 12 + 'The evaluation positions of the specified metric.\n'
                   + ' ' * 8 + _early_stop + _after_early_stop)