Mercurial > repos > bgruening > sklearn_stacking_ensemble_models
annotate search_model_validation.py @ 2:e18d9b17c322 draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
| author | bgruening | 
|---|---|
| date | Fri, 09 Aug 2019 13:52:50 -0400 | 
| parents | 47467890f541 | 
| children | 963e449636d3 | 
| rev | line source | 
|---|---|
| 0 
47467890f541
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 1 import argparse | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 2 import collections | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 3 import imblearn | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
 bgruening parents: 
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changeset | 4 import joblib | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 5 import json | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 6 import numpy as np | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
 bgruening parents: 
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changeset | 7 import pandas as pd | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 8 import pickle | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 9 import skrebate | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 10 import sklearn | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 11 import sys | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 12 import xgboost | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 13 import warnings | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 14 from imblearn import under_sampling, over_sampling, combine | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 15 from scipy.io import mmread | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 16 from mlxtend import classifier, regressor | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 17 from sklearn.base import clone | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 18 from sklearn import (cluster, compose, decomposition, ensemble, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 19 feature_extraction, feature_selection, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 20 gaussian_process, kernel_approximation, metrics, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 21 model_selection, naive_bayes, neighbors, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 22 pipeline, preprocessing, svm, linear_model, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 23 tree, discriminant_analysis) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 24 from sklearn.exceptions import FitFailedWarning | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 25 from sklearn.model_selection._validation import _score, cross_validate | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 26 from sklearn.model_selection import _search, _validation | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 27 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 28 from galaxy_ml.utils import (SafeEval, get_cv, get_scoring, load_model, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
 bgruening parents: 
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changeset | 29 read_columns, try_get_attr, get_module) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
 bgruening parents: 
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changeset | 30 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 31 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 32 _fit_and_score = try_get_attr('galaxy_ml.model_validations', '_fit_and_score') | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 33 setattr(_search, '_fit_and_score', _fit_and_score) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 34 setattr(_validation, '_fit_and_score', _fit_and_score) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 35 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 36 N_JOBS = int(__import__('os').environ.get('GALAXY_SLOTS', 1)) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 37 CACHE_DIR = './cached' | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 38 NON_SEARCHABLE = ('n_jobs', 'pre_dispatch', 'memory', '_path', | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 39 'nthread', 'callbacks') | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
 bgruening parents: 
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changeset | 40 ALLOWED_CALLBACKS = ('EarlyStopping', 'TerminateOnNaN', 'ReduceLROnPlateau', | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 41 'CSVLogger', 'None') | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 42 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 43 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 44 def _eval_search_params(params_builder): | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 45 search_params = {} | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 46 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 47 for p in params_builder['param_set']: | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 48 search_list = p['sp_list'].strip() | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 49 if search_list == '': | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 50 continue | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 51 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 52 param_name = p['sp_name'] | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 53 if param_name.lower().endswith(NON_SEARCHABLE): | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 54 print("Warning: `%s` is not eligible for search and was " | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 55 "omitted!" % param_name) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 56 continue | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 57 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 58 if not search_list.startswith(':'): | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 59 safe_eval = SafeEval(load_scipy=True, load_numpy=True) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 60 ev = safe_eval(search_list) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 61 search_params[param_name] = ev | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 62 else: | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 63 # Have `:` before search list, asks for estimator evaluatio | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 64 safe_eval_es = SafeEval(load_estimators=True) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 65 search_list = search_list[1:].strip() | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 66 # TODO maybe add regular express check | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 67 ev = safe_eval_es(search_list) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 68 preprocessings = ( | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 69 preprocessing.StandardScaler(), preprocessing.Binarizer(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 70 preprocessing.MaxAbsScaler(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 71 preprocessing.Normalizer(), preprocessing.MinMaxScaler(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 72 preprocessing.PolynomialFeatures(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 73 preprocessing.RobustScaler(), feature_selection.SelectKBest(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 74 feature_selection.GenericUnivariateSelect(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 75 feature_selection.SelectPercentile(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 76 feature_selection.SelectFpr(), feature_selection.SelectFdr(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 77 feature_selection.SelectFwe(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 78 feature_selection.VarianceThreshold(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 79 decomposition.FactorAnalysis(random_state=0), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 80 decomposition.FastICA(random_state=0), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 81 decomposition.IncrementalPCA(), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 82 decomposition.KernelPCA(random_state=0, n_jobs=N_JOBS), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 83 decomposition.LatentDirichletAllocation( | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 84 random_state=0, n_jobs=N_JOBS), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 85 decomposition.MiniBatchDictionaryLearning( | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 86 random_state=0, n_jobs=N_JOBS), | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 87 decomposition.MiniBatchSparsePCA( | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
 bgruening parents: diff
changeset | 88 random_state=0, n_jobs=N_JOBS), | 
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changeset | 89 decomposition.NMF(random_state=0), | 
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changeset | 90 decomposition.PCA(random_state=0), | 
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changeset | 91 decomposition.SparsePCA(random_state=0, n_jobs=N_JOBS), | 
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changeset | 92 decomposition.TruncatedSVD(random_state=0), | 
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changeset | 93 kernel_approximation.Nystroem(random_state=0), | 
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changeset | 94 kernel_approximation.RBFSampler(random_state=0), | 
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changeset | 95 kernel_approximation.AdditiveChi2Sampler(), | 
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changeset | 96 kernel_approximation.SkewedChi2Sampler(random_state=0), | 
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changeset | 97 cluster.FeatureAgglomeration(), | 
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changeset | 98 skrebate.ReliefF(n_jobs=N_JOBS), | 
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changeset | 99 skrebate.SURF(n_jobs=N_JOBS), | 
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changeset | 100 skrebate.SURFstar(n_jobs=N_JOBS), | 
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changeset | 101 skrebate.MultiSURF(n_jobs=N_JOBS), | 
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changeset | 102 skrebate.MultiSURFstar(n_jobs=N_JOBS), | 
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changeset | 103 imblearn.under_sampling.ClusterCentroids( | 
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changeset | 104 random_state=0, n_jobs=N_JOBS), | 
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changeset | 105 imblearn.under_sampling.CondensedNearestNeighbour( | 
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changeset | 106 random_state=0, n_jobs=N_JOBS), | 
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changeset | 107 imblearn.under_sampling.EditedNearestNeighbours( | 
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changeset | 108 random_state=0, n_jobs=N_JOBS), | 
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changeset | 109 imblearn.under_sampling.RepeatedEditedNearestNeighbours( | 
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changeset | 110 random_state=0, n_jobs=N_JOBS), | 
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changeset | 111 imblearn.under_sampling.AllKNN(random_state=0, n_jobs=N_JOBS), | 
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changeset | 112 imblearn.under_sampling.InstanceHardnessThreshold( | 
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changeset | 113 random_state=0, n_jobs=N_JOBS), | 
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changeset | 114 imblearn.under_sampling.NearMiss( | 
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changeset | 115 random_state=0, n_jobs=N_JOBS), | 
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changeset | 116 imblearn.under_sampling.NeighbourhoodCleaningRule( | 
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changeset | 117 random_state=0, n_jobs=N_JOBS), | 
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changeset | 118 imblearn.under_sampling.OneSidedSelection( | 
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changeset | 119 random_state=0, n_jobs=N_JOBS), | 
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changeset | 120 imblearn.under_sampling.RandomUnderSampler( | 
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changeset | 121 random_state=0), | 
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changeset | 122 imblearn.under_sampling.TomekLinks( | 
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changeset | 123 random_state=0, n_jobs=N_JOBS), | 
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changeset | 124 imblearn.over_sampling.ADASYN(random_state=0, n_jobs=N_JOBS), | 
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changeset | 125 imblearn.over_sampling.RandomOverSampler(random_state=0), | 
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changeset | 126 imblearn.over_sampling.SMOTE(random_state=0, n_jobs=N_JOBS), | 
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changeset | 127 imblearn.over_sampling.SVMSMOTE(random_state=0, n_jobs=N_JOBS), | 
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changeset | 128 imblearn.over_sampling.BorderlineSMOTE( | 
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changeset | 129 random_state=0, n_jobs=N_JOBS), | 
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changeset | 130 imblearn.over_sampling.SMOTENC( | 
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changeset | 131 categorical_features=[], random_state=0, n_jobs=N_JOBS), | 
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changeset | 132 imblearn.combine.SMOTEENN(random_state=0), | 
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changeset | 133 imblearn.combine.SMOTETomek(random_state=0)) | 
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changeset | 134 newlist = [] | 
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changeset | 135 for obj in ev: | 
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changeset | 136 if obj is None: | 
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changeset | 137 newlist.append(None) | 
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changeset | 138 elif obj == 'all_0': | 
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changeset | 139 newlist.extend(preprocessings[0:35]) | 
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changeset | 140 elif obj == 'sk_prep_all': # no KernalCenter() | 
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changeset | 141 newlist.extend(preprocessings[0:7]) | 
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changeset | 142 elif obj == 'fs_all': | 
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changeset | 143 newlist.extend(preprocessings[7:14]) | 
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changeset | 144 elif obj == 'decomp_all': | 
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changeset | 145 newlist.extend(preprocessings[14:25]) | 
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changeset | 146 elif obj == 'k_appr_all': | 
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changeset | 147 newlist.extend(preprocessings[25:29]) | 
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changeset | 148 elif obj == 'reb_all': | 
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changeset | 149 newlist.extend(preprocessings[30:35]) | 
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changeset | 150 elif obj == 'imb_all': | 
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changeset | 151 newlist.extend(preprocessings[35:54]) | 
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changeset | 152 elif type(obj) is int and -1 < obj < len(preprocessings): | 
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changeset | 153 newlist.append(preprocessings[obj]) | 
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changeset | 154 elif hasattr(obj, 'get_params'): # user uploaded object | 
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changeset | 155 if 'n_jobs' in obj.get_params(): | 
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changeset | 156 newlist.append(obj.set_params(n_jobs=N_JOBS)) | 
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changeset | 157 else: | 
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changeset | 158 newlist.append(obj) | 
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changeset | 159 else: | 
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changeset | 160 sys.exit("Unsupported estimator type: %r" % (obj)) | 
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changeset | 161 | 
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changeset | 162 search_params[param_name] = newlist | 
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changeset | 163 | 
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changeset | 164 return search_params | 
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changeset | 165 | 
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changeset | 166 | 
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changeset | 167 def main(inputs, infile_estimator, infile1, infile2, | 
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changeset | 168 outfile_result, outfile_object=None, | 
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changeset | 169 outfile_weights=None, groups=None, | 
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changeset | 170 ref_seq=None, intervals=None, targets=None, | 
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changeset | 171 fasta_path=None): | 
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changeset | 172 """ | 
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changeset | 173 Parameter | 
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changeset | 174 --------- | 
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changeset | 175 inputs : str | 
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changeset | 176 File path to galaxy tool parameter | 
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changeset | 177 | 
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changeset | 178 infile_estimator : str | 
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changeset | 179 File path to estimator | 
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changeset | 180 | 
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changeset | 181 infile1 : str | 
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changeset | 182 File path to dataset containing features | 
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changeset | 183 | 
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changeset | 184 infile2 : str | 
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changeset | 185 File path to dataset containing target values | 
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changeset | 186 | 
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changeset | 187 outfile_result : str | 
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changeset | 188 File path to save the results, either cv_results or test result | 
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changeset | 189 | 
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changeset | 190 outfile_object : str, optional | 
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changeset | 191 File path to save searchCV object | 
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changeset | 192 | 
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changeset | 193 outfile_weights : str, optional | 
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changeset | 194 File path to save model weights | 
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changeset | 195 | 
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changeset | 196 groups : str | 
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changeset | 197 File path to dataset containing groups labels | 
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changeset | 198 | 
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changeset | 199 ref_seq : str | 
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changeset | 200 File path to dataset containing genome sequence file | 
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changeset | 201 | 
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changeset | 202 intervals : str | 
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changeset | 203 File path to dataset containing interval file | 
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changeset | 204 | 
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changeset | 205 targets : str | 
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changeset | 206 File path to dataset compressed target bed file | 
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changeset | 207 | 
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changeset | 208 fasta_path : str | 
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changeset | 209 File path to dataset containing fasta file | 
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changeset | 210 """ | 
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changeset | 211 warnings.simplefilter('ignore') | 
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changeset | 212 | 
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changeset | 213 with open(inputs, 'r') as param_handler: | 
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changeset | 214 params = json.load(param_handler) | 
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changeset | 215 | 
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changeset | 216 params_builder = params['search_schemes']['search_params_builder'] | 
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changeset | 217 | 
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changeset | 218 with open(infile_estimator, 'rb') as estimator_handler: | 
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changeset | 219 estimator = load_model(estimator_handler) | 
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changeset | 220 estimator_params = estimator.get_params() | 
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changeset | 221 | 
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changeset | 222 # store read dataframe object | 
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changeset | 223 loaded_df = {} | 
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changeset | 224 | 
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changeset | 225 input_type = params['input_options']['selected_input'] | 
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changeset | 226 # tabular input | 
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changeset | 227 if input_type == 'tabular': | 
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changeset | 228 header = 'infer' if params['input_options']['header1'] else None | 
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changeset | 229 column_option = (params['input_options']['column_selector_options_1'] | 
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changeset | 230 ['selected_column_selector_option']) | 
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changeset | 231 if column_option in ['by_index_number', 'all_but_by_index_number', | 
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changeset | 232 'by_header_name', 'all_but_by_header_name']: | 
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changeset | 233 c = params['input_options']['column_selector_options_1']['col1'] | 
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changeset | 234 else: | 
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changeset | 235 c = None | 
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changeset | 236 | 
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changeset | 237 df_key = infile1 + repr(header) | 
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changeset | 238 df = pd.read_csv(infile1, sep='\t', header=header, | 
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changeset | 239 parse_dates=True) | 
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changeset | 240 loaded_df[df_key] = df | 
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changeset | 241 | 
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changeset | 242 X = read_columns(df, c=c, c_option=column_option).astype(float) | 
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changeset | 243 # sparse input | 
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changeset | 244 elif input_type == 'sparse': | 
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changeset | 245 X = mmread(open(infile1, 'r')) | 
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changeset | 246 | 
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changeset | 247 # fasta_file input | 
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changeset | 248 elif input_type == 'seq_fasta': | 
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changeset | 249 pyfaidx = get_module('pyfaidx') | 
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changeset | 250 sequences = pyfaidx.Fasta(fasta_path) | 
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changeset | 251 n_seqs = len(sequences.keys()) | 
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changeset | 252 X = np.arange(n_seqs)[:, np.newaxis] | 
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changeset | 253 for param in estimator_params.keys(): | 
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changeset | 254 if param.endswith('fasta_path'): | 
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changeset | 255 estimator.set_params( | 
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changeset | 256 **{param: fasta_path}) | 
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changeset | 257 break | 
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changeset | 258 else: | 
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changeset | 259 raise ValueError( | 
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changeset | 260 "The selected estimator doesn't support " | 
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changeset | 261 "fasta file input! Please consider using " | 
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changeset | 262 "KerasGBatchClassifier with " | 
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changeset | 263 "FastaDNABatchGenerator/FastaProteinBatchGenerator " | 
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changeset | 264 "or having GenomeOneHotEncoder/ProteinOneHotEncoder " | 
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changeset | 265 "in pipeline!") | 
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changeset | 266 | 
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changeset | 267 elif input_type == 'refseq_and_interval': | 
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changeset | 268 path_params = { | 
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changeset | 269 'data_batch_generator__ref_genome_path': ref_seq, | 
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changeset | 270 'data_batch_generator__intervals_path': intervals, | 
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changeset | 271 'data_batch_generator__target_path': targets | 
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changeset | 272 } | 
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changeset | 273 estimator.set_params(**path_params) | 
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changeset | 274 n_intervals = sum(1 for line in open(intervals)) | 
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changeset | 275 X = np.arange(n_intervals)[:, np.newaxis] | 
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changeset | 276 | 
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changeset | 277 # Get target y | 
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changeset | 278 header = 'infer' if params['input_options']['header2'] else None | 
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changeset | 279 column_option = (params['input_options']['column_selector_options_2'] | 
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changeset | 280 ['selected_column_selector_option2']) | 
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changeset | 281 if column_option in ['by_index_number', 'all_but_by_index_number', | 
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changeset | 282 'by_header_name', 'all_but_by_header_name']: | 
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changeset | 283 c = params['input_options']['column_selector_options_2']['col2'] | 
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changeset | 284 else: | 
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changeset | 285 c = None | 
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changeset | 286 | 
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changeset | 287 df_key = infile2 + repr(header) | 
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changeset | 288 if df_key in loaded_df: | 
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changeset | 289 infile2 = loaded_df[df_key] | 
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changeset | 290 else: | 
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changeset | 291 infile2 = pd.read_csv(infile2, sep='\t', | 
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changeset | 292 header=header, parse_dates=True) | 
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changeset | 293 loaded_df[df_key] = infile2 | 
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changeset | 294 | 
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changeset | 295 y = read_columns( | 
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changeset | 296 infile2, | 
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changeset | 297 c=c, | 
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changeset | 298 c_option=column_option, | 
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changeset | 299 sep='\t', | 
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changeset | 300 header=header, | 
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changeset | 301 parse_dates=True) | 
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changeset | 302 if len(y.shape) == 2 and y.shape[1] == 1: | 
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changeset | 303 y = y.ravel() | 
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changeset | 304 if input_type == 'refseq_and_interval': | 
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changeset | 305 estimator.set_params( | 
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changeset | 306 data_batch_generator__features=y.ravel().tolist()) | 
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changeset | 307 y = None | 
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changeset | 308 # end y | 
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changeset | 309 | 
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changeset | 310 optimizer = params['search_schemes']['selected_search_scheme'] | 
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changeset | 311 optimizer = getattr(model_selection, optimizer) | 
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changeset | 312 | 
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changeset | 313 # handle gridsearchcv options | 
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changeset | 314 options = params['search_schemes']['options'] | 
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changeset | 315 | 
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changeset | 316 if groups: | 
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changeset | 317 header = 'infer' if (options['cv_selector']['groups_selector'] | 
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changeset | 318 ['header_g']) else None | 
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changeset | 319 column_option = (options['cv_selector']['groups_selector'] | 
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changeset | 320 ['column_selector_options_g'] | 
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changeset | 321 ['selected_column_selector_option_g']) | 
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changeset | 322 if column_option in ['by_index_number', 'all_but_by_index_number', | 
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changeset | 323 'by_header_name', 'all_but_by_header_name']: | 
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changeset | 324 c = (options['cv_selector']['groups_selector'] | 
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changeset | 325 ['column_selector_options_g']['col_g']) | 
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changeset | 326 else: | 
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changeset | 327 c = None | 
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changeset | 328 | 
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changeset | 329 df_key = groups + repr(header) | 
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changeset | 330 if df_key in loaded_df: | 
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changeset | 331 groups = loaded_df[df_key] | 
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changeset | 332 | 
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changeset | 333 groups = read_columns( | 
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changeset | 334 groups, | 
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changeset | 335 c=c, | 
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changeset | 336 c_option=column_option, | 
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changeset | 337 sep='\t', | 
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changeset | 338 header=header, | 
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changeset | 339 parse_dates=True) | 
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changeset | 340 groups = groups.ravel() | 
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changeset | 341 options['cv_selector']['groups_selector'] = groups | 
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changeset | 342 | 
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changeset | 343 splitter, groups = get_cv(options.pop('cv_selector')) | 
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changeset | 344 options['cv'] = splitter | 
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changeset | 345 options['n_jobs'] = N_JOBS | 
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changeset | 346 primary_scoring = options['scoring']['primary_scoring'] | 
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changeset | 347 options['scoring'] = get_scoring(options['scoring']) | 
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changeset | 348 if options['error_score']: | 
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changeset | 349 options['error_score'] = 'raise' | 
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changeset | 350 else: | 
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changeset | 351 options['error_score'] = np.NaN | 
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changeset | 352 if options['refit'] and isinstance(options['scoring'], dict): | 
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changeset | 353 options['refit'] = primary_scoring | 
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changeset | 354 if 'pre_dispatch' in options and options['pre_dispatch'] == '': | 
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changeset | 355 options['pre_dispatch'] = None | 
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changeset | 356 | 
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changeset | 357 # del loaded_df | 
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changeset | 358 del loaded_df | 
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changeset | 359 | 
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changeset | 360 # handle memory | 
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changeset | 361 memory = joblib.Memory(location=CACHE_DIR, verbose=0) | 
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changeset | 362 # cache iraps_core fits could increase search speed significantly | 
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changeset | 363 if estimator.__class__.__name__ == 'IRAPSClassifier': | 
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changeset | 364 estimator.set_params(memory=memory) | 
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changeset | 365 else: | 
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changeset | 366 # For iraps buried in pipeline | 
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changeset | 367 for p, v in estimator_params.items(): | 
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changeset | 368 if p.endswith('memory'): | 
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changeset | 369 # for case of `__irapsclassifier__memory` | 
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changeset | 370 if len(p) > 8 and p[:-8].endswith('irapsclassifier'): | 
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changeset | 371 # cache iraps_core fits could increase search | 
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changeset | 372 # speed significantly | 
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changeset | 373 new_params = {p: memory} | 
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changeset | 374 estimator.set_params(**new_params) | 
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changeset | 375 # security reason, we don't want memory being | 
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changeset | 376 # modified unexpectedly | 
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changeset | 377 elif v: | 
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changeset | 378 new_params = {p, None} | 
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changeset | 379 estimator.set_params(**new_params) | 
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changeset | 380 # For now, 1 CPU is suggested for iprasclassifier | 
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changeset | 381 elif p.endswith('n_jobs'): | 
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changeset | 382 new_params = {p: 1} | 
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changeset | 383 estimator.set_params(**new_params) | 
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changeset | 384 # for security reason, types of callbacks are limited | 
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changeset | 385 elif p.endswith('callbacks'): | 
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changeset | 386 for cb in v: | 
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changeset | 387 cb_type = cb['callback_selection']['callback_type'] | 
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changeset | 388 if cb_type not in ALLOWED_CALLBACKS: | 
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changeset | 389 raise ValueError( | 
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changeset | 390 "Prohibited callback type: %s!" % cb_type) | 
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changeset | 391 | 
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changeset | 392 param_grid = _eval_search_params(params_builder) | 
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changeset | 393 searcher = optimizer(estimator, param_grid, **options) | 
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changeset | 394 | 
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changeset | 395 # do nested split | 
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changeset | 396 split_mode = params['outer_split'].pop('split_mode') | 
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changeset | 397 # nested CV, outer cv using cross_validate | 
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changeset | 398 if split_mode == 'nested_cv': | 
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changeset | 399 outer_cv, _ = get_cv(params['outer_split']['cv_selector']) | 
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changeset | 400 | 
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changeset | 401 if options['error_score'] == 'raise': | 
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changeset | 402 rval = cross_validate( | 
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changeset | 403 searcher, X, y, scoring=options['scoring'], | 
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changeset | 404 cv=outer_cv, n_jobs=N_JOBS, verbose=0, | 
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changeset | 405 error_score=options['error_score']) | 
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changeset | 406 else: | 
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changeset | 407 warnings.simplefilter('always', FitFailedWarning) | 
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changeset | 408 with warnings.catch_warnings(record=True) as w: | 
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changeset | 409 try: | 
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changeset | 410 rval = cross_validate( | 
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changeset | 411 searcher, X, y, | 
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changeset | 412 scoring=options['scoring'], | 
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changeset | 413 cv=outer_cv, n_jobs=N_JOBS, | 
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changeset | 414 verbose=0, | 
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changeset | 415 error_score=options['error_score']) | 
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changeset | 416 except ValueError: | 
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changeset | 417 pass | 
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changeset | 418 for warning in w: | 
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changeset | 419 print(repr(warning.message)) | 
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changeset | 420 | 
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changeset | 421 keys = list(rval.keys()) | 
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changeset | 422 for k in keys: | 
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changeset | 423 if k.startswith('test'): | 
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changeset | 424 rval['mean_' + k] = np.mean(rval[k]) | 
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changeset | 425 rval['std_' + k] = np.std(rval[k]) | 
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changeset | 426 if k.endswith('time'): | 
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changeset | 427 rval.pop(k) | 
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changeset | 428 rval = pd.DataFrame(rval) | 
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changeset | 429 rval = rval[sorted(rval.columns)] | 
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changeset | 430 rval.to_csv(path_or_buf=outfile_result, sep='\t', | 
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changeset | 431 header=True, index=False) | 
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changeset | 432 else: | 
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changeset | 433 if split_mode == 'train_test_split': | 
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changeset | 434 train_test_split = try_get_attr( | 
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changeset | 435 'galaxy_ml.model_validations', 'train_test_split') | 
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changeset | 436 # make sure refit is choosen | 
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changeset | 437 # this could be True for sklearn models, but not the case for | 
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changeset | 438 # deep learning models | 
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changeset | 439 if not options['refit'] and \ | 
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changeset | 440 not all(hasattr(estimator, attr) | 
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changeset | 441 for attr in ('config', 'model_type')): | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 442 warnings.warn("Refit is change to `True` for nested " | 
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changeset | 443 "validation!") | 
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changeset | 444 setattr(searcher, 'refit', True) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 445 split_options = params['outer_split'] | 
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changeset | 446 | 
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changeset | 447 # splits | 
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changeset | 448 if split_options['shuffle'] == 'stratified': | 
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changeset | 449 split_options['labels'] = y | 
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changeset | 450 X, X_test, y, y_test = train_test_split(X, y, **split_options) | 
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changeset | 451 elif split_options['shuffle'] == 'group': | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 452 if groups is None: | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 453 raise ValueError("No group based CV option was " | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 454 "choosen for group shuffle!") | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 455 split_options['labels'] = groups | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 456 if y is None: | 
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changeset | 457 X, X_test, groups, _ =\ | 
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changeset | 458 train_test_split(X, groups, **split_options) | 
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changeset | 459 else: | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 460 X, X_test, y, y_test, groups, _ =\ | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 461 train_test_split(X, y, groups, **split_options) | 
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changeset | 462 else: | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 463 if split_options['shuffle'] == 'None': | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 464 split_options['shuffle'] = None | 
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changeset | 465 X, X_test, y, y_test =\ | 
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changeset | 466 train_test_split(X, y, **split_options) | 
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changeset | 467 # end train_test_split | 
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changeset | 468 | 
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changeset | 469 # shared by both train_test_split and non-split | 
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changeset | 470 if options['error_score'] == 'raise': | 
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changeset | 471 searcher.fit(X, y, groups=groups) | 
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changeset | 472 else: | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 473 warnings.simplefilter('always', FitFailedWarning) | 
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changeset | 474 with warnings.catch_warnings(record=True) as w: | 
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changeset | 475 try: | 
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changeset | 476 searcher.fit(X, y, groups=groups) | 
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changeset | 477 except ValueError: | 
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changeset | 478 pass | 
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changeset | 479 for warning in w: | 
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changeset | 480 print(repr(warning.message)) | 
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changeset | 481 | 
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changeset | 482 # no outer split | 
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changeset | 483 if split_mode == 'no': | 
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changeset | 484 # save results | 
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changeset | 485 cv_results = pd.DataFrame(searcher.cv_results_) | 
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changeset | 486 cv_results = cv_results[sorted(cv_results.columns)] | 
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changeset | 487 cv_results.to_csv(path_or_buf=outfile_result, sep='\t', | 
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changeset | 488 header=True, index=False) | 
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changeset | 489 | 
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changeset | 490 # train_test_split, output test result using best_estimator_ | 
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changeset | 491 # or rebuild the trained estimator using weights if applicable. | 
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changeset | 492 else: | 
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changeset | 493 scorer_ = searcher.scorer_ | 
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changeset | 494 if isinstance(scorer_, collections.Mapping): | 
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changeset | 495 is_multimetric = True | 
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changeset | 496 else: | 
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changeset | 497 is_multimetric = False | 
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changeset | 498 | 
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changeset | 499 best_estimator_ = getattr(searcher, 'best_estimator_', None) | 
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changeset | 500 if not best_estimator_: | 
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changeset | 501 raise ValueError("GridSearchCV object has no " | 
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changeset | 502 "`best_estimator_` when `refit`=False!") | 
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changeset | 503 | 
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changeset | 504 if best_estimator_.__class__.__name__ == 'KerasGBatchClassifier' \ | 
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changeset | 505 and hasattr(estimator.data_batch_generator, 'target_path'): | 
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changeset | 506 test_score = best_estimator_.evaluate( | 
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changeset | 507 X_test, scorer=scorer_, is_multimetric=is_multimetric) | 
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changeset | 508 else: | 
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changeset | 509 test_score = _score(best_estimator_, X_test, | 
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changeset | 510 y_test, scorer_, | 
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changeset | 511 is_multimetric=is_multimetric) | 
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changeset | 512 | 
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changeset | 513 if not is_multimetric: | 
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changeset | 514 test_score = {primary_scoring: test_score} | 
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changeset | 515 for key, value in test_score.items(): | 
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changeset | 516 test_score[key] = [value] | 
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changeset | 517 result_df = pd.DataFrame(test_score) | 
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changeset | 518 result_df.to_csv(path_or_buf=outfile_result, sep='\t', | 
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changeset | 519 header=True, index=False) | 
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changeset | 520 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 521 memory.clear(warn=False) | 
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changeset | 522 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 523 if outfile_object: | 
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changeset | 524 best_estimator_ = getattr(searcher, 'best_estimator_', None) | 
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changeset | 525 if not best_estimator_: | 
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changeset | 526 warnings.warn("GridSearchCV object has no attribute " | 
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changeset | 527 "'best_estimator_', because either it's " | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 528 "nested gridsearch or `refit` is False!") | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 529 return | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 530 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 531 main_est = best_estimator_ | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 532 if isinstance(best_estimator_, pipeline.Pipeline): | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 533 main_est = best_estimator_.steps[-1][-1] | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 534 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 535 if hasattr(main_est, 'model_') \ | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 536 and hasattr(main_est, 'save_weights'): | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 537 if outfile_weights: | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 538 main_est.save_weights(outfile_weights) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 539 del main_est.model_ | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 540 del main_est.fit_params | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 541 del main_est.model_class_ | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 542 del main_est.validation_data | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 543 if getattr(main_est, 'data_generator_', None): | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 544 del main_est.data_generator_ | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 545 del main_est.data_batch_generator | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 546 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 547 with open(outfile_object, 'wb') as output_handler: | 
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changeset | 548 pickle.dump(best_estimator_, output_handler, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 549 pickle.HIGHEST_PROTOCOL) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 550 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 551 | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 552 if __name__ == '__main__': | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 553 aparser = argparse.ArgumentParser() | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 554 aparser.add_argument("-i", "--inputs", dest="inputs", required=True) | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 555 aparser.add_argument("-e", "--estimator", dest="infile_estimator") | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 556 aparser.add_argument("-X", "--infile1", dest="infile1") | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 557 aparser.add_argument("-y", "--infile2", dest="infile2") | 
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changeset | 558 aparser.add_argument("-O", "--outfile_result", dest="outfile_result") | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 559 aparser.add_argument("-o", "--outfile_object", dest="outfile_object") | 
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changeset | 560 aparser.add_argument("-w", "--outfile_weights", dest="outfile_weights") | 
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changeset | 561 aparser.add_argument("-g", "--groups", dest="groups") | 
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changeset | 562 aparser.add_argument("-r", "--ref_seq", dest="ref_seq") | 
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changeset | 563 aparser.add_argument("-b", "--intervals", dest="intervals") | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 564 aparser.add_argument("-t", "--targets", dest="targets") | 
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changeset | 565 aparser.add_argument("-f", "--fasta_path", dest="fasta_path") | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 566 args = aparser.parse_args() | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit ab963ec9498bd05d2fb2f24f75adb2fccae7958c
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changeset | 567 | 
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changeset | 568 main(args.inputs, args.infile_estimator, args.infile1, args.infile2, | 
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changeset | 569 args.outfile_result, outfile_object=args.outfile_object, | 
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changeset | 570 outfile_weights=args.outfile_weights, groups=args.groups, | 
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changeset | 571 ref_seq=args.ref_seq, intervals=args.intervals, | 
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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/sklearn commit c035d399196b3bef9982db4f8e47331411dbb20e
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changeset | 572 targets=args.targets, fasta_path=args.fasta_path) | 
