Run
9870299

Run 9870299

Task 9957 (Supervised Classification) qsar-biodeg Uploaded 07-12-2018 by Scikit-learn Bot
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Flow

sklearn.pipeline.Pipeline(columntransformer=sklearn.compose._column_transfo rmer.ColumnTransformer(numeric=sklearn.pipeline.Pipeline(imputer=sklearn.pr eprocessing.imputation.Imputer,standardscaler=sklearn.preprocessing.data.St andardScaler),nominal=sklearn.pipeline.Pipeline(simpleimputer=sklearn.imput e.SimpleImputer,onehotencoder=sklearn.preprocessing._encoders.OneHotEncoder )),variancethreshold=sklearn.feature_selection.variance_threshold.VarianceT hreshold,gradientboostingclassifier=sklearn.ensemble.gradient_boosting.Grad ientBoostingClassifier)(1)Automatically created scikit-learn flow.
sklearn.pipeline.Pipeline(columntransformer=sklearn.compose._column_transformer.ColumnTransformer(numeric=sklearn.pipeline.Pipeline(imputer=sklearn.preprocessing.imputation.Imputer,standardscaler=sklearn.preprocessing.data.StandardScaler),nominal=sklearn.pipeline.Pipeline(simpleimputer=sklearn.impute.SimpleImputer,onehotencoder=sklearn.preprocessing._encoders.OneHotEncoder)),variancethreshold=sklearn.feature_selection.variance_threshold.VarianceThreshold,gradientboostingclassifier=sklearn.ensemble.gradient_boosting.GradientBoostingClassifier)(1)_memorynull
sklearn.compose._column_transformer.ColumnTransformer(numeric=sklearn.pipeline.Pipeline(imputer=sklearn.preprocessing.imputation.Imputer,standardscaler=sklearn.preprocessing.data.StandardScaler),nominal=sklearn.pipeline.Pipeline(simpleimputer=sklearn.impute.SimpleImputer,onehotencoder=sklearn.preprocessing._encoders.OneHotEncoder))(2)_n_jobsnull
sklearn.compose._column_transformer.ColumnTransformer(numeric=sklearn.pipeline.Pipeline(imputer=sklearn.preprocessing.imputation.Imputer,standardscaler=sklearn.preprocessing.data.StandardScaler),nominal=sklearn.pipeline.Pipeline(simpleimputer=sklearn.impute.SimpleImputer,onehotencoder=sklearn.preprocessing._encoders.OneHotEncoder))(2)_remainder"passthrough"
sklearn.compose._column_transformer.ColumnTransformer(numeric=sklearn.pipeline.Pipeline(imputer=sklearn.preprocessing.imputation.Imputer,standardscaler=sklearn.preprocessing.data.StandardScaler),nominal=sklearn.pipeline.Pipeline(simpleimputer=sklearn.impute.SimpleImputer,onehotencoder=sklearn.preprocessing._encoders.OneHotEncoder))(2)_sparse_threshold0.3
sklearn.compose._column_transformer.ColumnTransformer(numeric=sklearn.pipeline.Pipeline(imputer=sklearn.preprocessing.imputation.Imputer,standardscaler=sklearn.preprocessing.data.StandardScaler),nominal=sklearn.pipeline.Pipeline(simpleimputer=sklearn.impute.SimpleImputer,onehotencoder=sklearn.preprocessing._encoders.OneHotEncoder))(2)_transformer_weightsnull
sklearn.pipeline.Pipeline(imputer=sklearn.preprocessing.imputation.Imputer,standardscaler=sklearn.preprocessing.data.StandardScaler)(2)_memorynull
sklearn.preprocessing.imputation.Imputer(31)_axis0
sklearn.preprocessing.imputation.Imputer(31)_copytrue
sklearn.preprocessing.imputation.Imputer(31)_missing_values"NaN"
sklearn.preprocessing.imputation.Imputer(31)_strategy"median"
sklearn.preprocessing.imputation.Imputer(31)_verbose0
sklearn.preprocessing.data.StandardScaler(17)_copytrue
sklearn.preprocessing.data.StandardScaler(17)_with_meantrue
sklearn.preprocessing.data.StandardScaler(17)_with_stdtrue
sklearn.pipeline.Pipeline(simpleimputer=sklearn.impute.SimpleImputer,onehotencoder=sklearn.preprocessing._encoders.OneHotEncoder)(2)_memorynull
sklearn.impute.SimpleImputer(2)_copytrue
sklearn.impute.SimpleImputer(2)_fill_value-1
sklearn.impute.SimpleImputer(2)_missing_valuesNaN
sklearn.impute.SimpleImputer(2)_strategy"constant"
sklearn.impute.SimpleImputer(2)_verbose0
sklearn.preprocessing._encoders.OneHotEncoder(5)_categorical_featuresnull
sklearn.preprocessing._encoders.OneHotEncoder(5)_categoriesnull
sklearn.preprocessing._encoders.OneHotEncoder(5)_dtype{"oml-python:serialized_object": "type", "value": "np.float64"}
sklearn.preprocessing._encoders.OneHotEncoder(5)_handle_unknown"ignore"
sklearn.preprocessing._encoders.OneHotEncoder(5)_n_valuesnull
sklearn.preprocessing._encoders.OneHotEncoder(5)_sparsetrue
sklearn.feature_selection.variance_threshold.VarianceThreshold(19)_threshold0.0
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_criterion"mae"
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_initnull
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_learning_rate0.06360330172263788
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_loss"deviance"
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_max_depth2
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_max_features0.6443615494176822
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_max_leaf_nodesnull
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_min_impurity_decrease0.9425467034479551
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_min_impurity_splitnull
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_min_samples_leaf6
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_min_samples_split11
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_min_weight_fraction_leaf0.44162560963898706
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_n_estimators289
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_n_iter_no_change314
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_presort"auto"
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_random_state22256
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_subsample0.8929044642863158
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_tol4.2111288246720794e-05
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_validation_fraction0.17528382761937877
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_verbose0
sklearn.ensemble.gradient_boosting.GradientBoostingClassifier(15)_warm_startfalse

Result files

xml
Description

XML file describing the run, including user-defined evaluation measures.

arff
Predictions

ARFF file with instance-level predictions generated by the model.

15 Evaluation measures

Area under ROC curve
0.4967
Per class
Cross-validation details (10-fold Crossvalidation)
KB relative information score
2.4712 ± 0.0674
Cross-validation details (10-fold Crossvalidation)
Mean absolute error
0.4463 ± 0.001
Cross-validation details (10-fold Crossvalidation)
Mean prior absolute error
0.4472 ± 0.0012
Cross-validation details (10-fold Crossvalidation)
Number of instances
1055
Per class
Cross-validation details (10-fold Crossvalidation)
Predictive accuracy
0.6626 ± 0.0037
Cross-validation details (10-fold Crossvalidation)
Prior entropy
0.9226
Cross-validation details (10-fold Crossvalidation)
Recall
0.6626 ± 0.0037
Per class
Cross-validation details (10-fold Crossvalidation)
Relative absolute error
0.9978 ± 0.0006
Cross-validation details (10-fold Crossvalidation)
Root mean prior squared error
0.4728 ± 0.0013
Cross-validation details (10-fold Crossvalidation)
Root mean squared error
0.4729 ± 0.0013
Cross-validation details (10-fold Crossvalidation)
Root relative squared error
1 ± 0.0001
Cross-validation details (10-fold Crossvalidation)