chemotools 0.0.18__tar.gz → 0.0.19__tar.gz

{chemotools-0.0.18 → chemotools-0.0.19}/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.1
 Name: chemotools
-Version: 0.0.18
+Version: 0.0.19
 Summary: Package to integrate chemometrics in scikit-learn pipelines
 Home-page: https://github.com/paucablop/chemotools
 Author: Pau Cabaneros Lopez
@@ -13,7 +13,7 @@ Requires-Python: >=3.9
 Description-Content-Type: text/markdown
 License-File: LICENSE
 
-![chemotools](assets/images/logo_2.png)
+![chemotools](assets/images/logo_5.png)
 
 
 [![pypi](https://img.shields.io/pypi/v/chemotools)](https://pypi.org/project/chemotools)

{chemotools-0.0.18 → chemotools-0.0.19}/README.md

@@ -1,4 +1,4 @@
-![chemotools](assets/images/logo_2.png)
+![chemotools](assets/images/logo_5.png)
 
 
 [![pypi](https://img.shields.io/pypi/v/chemotools)](https://pypi.org/project/chemotools)

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/baseline/air_pls.py

@@ -2,7 +2,7 @@ import logging
 import numpy as np
 from scipy.sparse import csc_matrix, eye, diags
 from scipy.sparse.linalg import spsolve
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
@@ -15,7 +15,7 @@ logger = logging.getLogger(__name__)
 # Analyst 135 (5), 1138-1146 (2010).P
 
 
-class AirPls(BaseEstimator, TransformerMixin):
+class AirPls(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self,
         nr_iterations: int = 15,

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/baseline/constant_baseline_correction.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class ConstantBaselineCorrection(BaseEstimator, TransformerMixin):
+class ConstantBaselineCorrection(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self, wavenumbers: np.ndarray = None, start: int = 0, end: int = 1
     ) -> None:

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/baseline/cubic_spline_correction.py

@@ -1,11 +1,11 @@
 import numpy as np
 from scipy.interpolate import CubicSpline
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
-class CubicSplineCorrection(BaseEstimator, TransformerMixin):
+class CubicSplineCorrection(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, indices: np.ndarray = None) -> None:
         self.indices = indices
 

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/baseline/linear_correction.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class LinearCorrection(BaseEstimator, TransformerMixin):
+class LinearCorrection(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
 
     def _drift_correct_spectrum(self, x: np.ndarray) -> np.ndarray:
 

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/baseline/non_negative.py

@@ -1,12 +1,12 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
 
-class NonNegative(BaseEstimator, TransformerMixin):
+class NonNegative(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, mode: str = "zero"):
         self.mode = mode
 

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/baseline/polynomial_correction.py

@@ -1,10 +1,10 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
-class PolynomialCorrection(BaseEstimator, TransformerMixin):
+class PolynomialCorrection(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, order: int = 1, indices: list = None) -> None:
         self.order = order
         self.indices = indices

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/baseline/subtract_reference.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class SubtractReference(BaseEstimator, TransformerMixin):
+class SubtractReference(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self,
         reference: np.ndarray = None,

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/derivative/norris_william.py

@@ -1,12 +1,12 @@
 import numpy as np
 from scipy.ndimage import convolve1d
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class NorrisWilliams(BaseEstimator, TransformerMixin):
+class NorrisWilliams(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self,
         window_size: int = 5,

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/derivative/savitzky_golay.py

@@ -1,12 +1,12 @@
 import numpy as np
 from scipy.signal import savgol_filter
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class SavitzkyGolay(BaseEstimator, TransformerMixin):
+class SavitzkyGolay(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self, window_size: int = 3, polynomial_order: int = 1, derivate_order: int = 1, mode: str = "nearest"
     ) -> None:

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/scale/index_scaler.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class IndexScaler(BaseEstimator, TransformerMixin):
+class IndexScaler(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, index: int = 0):
         self.index = index
 

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/scale/min_max_scaler.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class MinMaxScaler(BaseEstimator, TransformerMixin):
+class MinMaxScaler(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, norm: str = 'max'):
         self.norm = norm
 

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/scale/norm_scaler.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class NormScaler(BaseEstimator, TransformerMixin):
+class NormScaler(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, l_norm: int = 2):
         self.l_norm = l_norm
 

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/scatter/multiplicative_scatter_correction.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class MultiplicativeScatterCorrection(BaseEstimator, TransformerMixin):
+class MultiplicativeScatterCorrection(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self,
         reference: np.ndarray = None,

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/scatter/standard_normal_variate.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class StandardNormalVariate(BaseEstimator, TransformerMixin):
+class StandardNormalVariate(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def fit(self, X: np.ndarray, y=None) -> "StandardNormalVariate":
         # Check that X is a 2D array and has only finite values
         X = check_input(X)

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/smooth/mean_filter.py

@@ -1,12 +1,12 @@
 import numpy as np
 from scipy.ndimage import uniform_filter1d
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class MeanFilter(BaseEstimator, TransformerMixin):
+class MeanFilter(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, window_size: int = 3, mode='nearest') -> None:
         self.window_size = window_size
         self.mode = mode

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/smooth/median_filter.py

@@ -1,12 +1,12 @@
 import numpy as np
 from scipy.ndimage import median_filter
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class MedianFilter(BaseEstimator, TransformerMixin):
+class MedianFilter(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(self, window_size: int = 3, mode: str = 'nearest') -> None:
         self.window_size = window_size
         self.mode = mode

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/smooth/savitzky_golay_filter.py

@@ -1,12 +1,12 @@
 import numpy as np
 from scipy.signal import savgol_filter
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class SavitzkyGolayFilter(BaseEstimator, TransformerMixin):
+class SavitzkyGolayFilter(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self, window_size: int = 3, polynomial_order: int = 1, mode: str = "nearest"
     ) -> None:

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/smooth/whittaker_smooth.py

@@ -1,7 +1,7 @@
 import numpy as np
 from scipy.sparse import csc_matrix, eye, diags
 from scipy.sparse.linalg import spsolve
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
@@ -12,7 +12,7 @@ from chemotools.utils.check_inputs import check_input
 # Analyst 135 (5), 1138-1146 (2010).
 
 
-class WhittakerSmooth(BaseEstimator, TransformerMixin):
+class WhittakerSmooth(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self,
         lam: float = 1e2,

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools/variable_selection/range_cut.py

@@ -1,11 +1,11 @@
 import numpy as np
-from sklearn.base import BaseEstimator, TransformerMixin
+from sklearn.base import BaseEstimator, TransformerMixin, OneToOneFeatureMixin
 from sklearn.utils.validation import check_is_fitted
 
 from chemotools.utils.check_inputs import check_input
 
 
-class RangeCut(BaseEstimator, TransformerMixin):
+class RangeCut(OneToOneFeatureMixin, BaseEstimator, TransformerMixin):
     def __init__(
         self,
         wavenumbers: np.ndarray = None,

{chemotools-0.0.18 → chemotools-0.0.19}/chemotools.egg-info/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.1
 Name: chemotools
-Version: 0.0.18
+Version: 0.0.19
 Summary: Package to integrate chemometrics in scikit-learn pipelines
 Home-page: https://github.com/paucablop/chemotools
 Author: Pau Cabaneros Lopez
@@ -13,7 +13,7 @@ Requires-Python: >=3.9
 Description-Content-Type: text/markdown
 License-File: LICENSE
 
-![chemotools](assets/images/logo_2.png)
+![chemotools](assets/images/logo_5.png)
 
 
 [![pypi](https://img.shields.io/pypi/v/chemotools)](https://pypi.org/project/chemotools)