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"""
Numerical Python functions written for compatibility with MATLAB
commands with the same names. Most numerical Python functions can be found in
the `NumPy`_ and `SciPy`_ libraries. What remains here is code for performing
spectral computations and kernel density estimations.
.. _NumPy: https://numpy.org
.. _SciPy: https://www.scipy.org
Spectral functions
------------------
`cohere`
Coherence (normalized cross spectral density)
`csd`
Cross spectral density using Welch's average periodogram
`detrend`
Remove the mean or best fit line from an array
`psd`
Power spectral density using Welch's average periodogram
`specgram`
Spectrogram (spectrum over segments of time)
`complex_spectrum`
Return the complex-valued frequency spectrum of a signal
`magnitude_spectrum`
Return the magnitude of the frequency spectrum of a signal
`angle_spectrum`
Return the angle (wrapped phase) of the frequency spectrum of a signal
`phase_spectrum`
Return the phase (unwrapped angle) of the frequency spectrum of a signal
`detrend_mean`
Remove the mean from a line.
`detrend_linear`
Remove the best fit line from a line.
`detrend_none`
Return the original line.
"""
import functools
from numbers import Integral, Number
import sys
import numpy as np
from matplotlib import _api, _docstring, cbook
def window_hanning(x):
"""
Return *x* times the Hanning (or Hann) window of len(*x*).
See Also
--------
window_none : Another window algorithm.
"""
return np.hanning(len(x))*x
def window_none(x):
"""
No window function; simply return *x*.
See Also
--------
window_hanning : Another window algorithm.
"""
return x
def detrend(x, key=None, axis=None):
"""
Return *x* with its trend removed.
Parameters
----------
x : array or sequence
Array or sequence containing the data.
key : {'default', 'constant', 'mean', 'linear', 'none'} or function
The detrending algorithm to use. 'default', 'mean', and 'constant' are
the same as `detrend_mean`. 'linear' is the same as `detrend_linear`.
'none' is the same as `detrend_none`. The default is 'mean'. See the
corresponding functions for more details regarding the algorithms. Can
also be a function that carries out the detrend operation.
axis : int
The axis along which to do the detrending.
See Also
--------
detrend_mean : Implementation of the 'mean' algorithm.
detrend_linear : Implementation of the 'linear' algorithm.
detrend_none : Implementation of the 'none' algorithm.
"""
if key is None or key in ['constant', 'mean', 'default']:
return detrend(x, key=detrend_mean, axis=axis)
elif key == 'linear':
return detrend(x, key=detrend_linear, axis=axis)
elif key == 'none':
return detrend(x, key=detrend_none, axis=axis)
elif callable(key):
x = np.asarray(x)
if axis is not None and axis + 1 > x.ndim:
raise ValueError(f'axis(={axis}) out of bounds')
if (axis is None and x.ndim == 0) or (not axis and x.ndim == 1):
return key(x)
# try to use the 'axis' argument if the function supports it,
# otherwise use apply_along_axis to do it
try:
return key(x, axis=axis)
except TypeError:
return np.apply_along_axis(key, axis=axis, arr=x)
else:
raise ValueError(
f"Unknown value for key: {key!r}, must be one of: 'default', "
f"'constant', 'mean', 'linear', or a function")
def detrend_mean(x, axis=None):
"""
Return *x* minus the mean(*x*).
Parameters
----------
x : array or sequence
Array or sequence containing the data
Can have any dimensionality
axis : int
The axis along which to take the mean. See `numpy.mean` for a
description of this argument.
See Also
--------
detrend_linear : Another detrend algorithm.
detrend_none : Another detrend algorithm.
detrend : A wrapper around all the detrend algorithms.
"""
x = np.asarray(x)
if axis is not None and axis+1 > x.ndim:
raise ValueError('axis(=%s) out of bounds' % axis)
return x - x.mean(axis, keepdims=True)
def detrend_none(x, axis=None):
"""
Return *x*: no detrending.
Parameters
----------
x : any object
An object containing the data
axis : int
This parameter is ignored.
It is included for compatibility with detrend_mean
See Also
--------
detrend_mean : Another detrend algorithm.
detrend_linear : Another detrend algorithm.
detrend : A wrapper around all the detrend algorithms.
"""
return x
def detrend_linear(y):
"""
Return *x* minus best fit line; 'linear' detrending.
Parameters
----------
y : 0-D or 1-D array or sequence
Array or sequence containing the data
See Also
--------
detrend_mean : Another detrend algorithm.
detrend_none : Another detrend algorithm.
detrend : A wrapper around all the detrend algorithms.
"""
# This is faster than an algorithm based on linalg.lstsq.
y = np.asarray(y)
if y.ndim > 1:
raise ValueError('y cannot have ndim > 1')
# short-circuit 0-D array.
if not y.ndim:
return np.array(0., dtype=y.dtype)
x = np.arange(y.size, dtype=float)
C = np.cov(x, y, bias=1)
b = C[0, 1]/C[0, 0]
a = y.mean() - b*x.mean()
return y - (b*x + a)
def _stride_windows(x, n, noverlap=0):
_api.check_isinstance(Integral, n=n, noverlap=noverlap)
x = np.asarray(x)
step = n - noverlap
shape = (n, (x.shape[-1]-noverlap)//step)
strides = (x.strides[0], step*x.strides[0])
return np.lib.stride_tricks.as_strided(x, shape=shape, strides=strides)
def _spectral_helper(x, y=None, NFFT=None, Fs=None, detrend_func=None,
window=None, noverlap=None, pad_to=None,
sides=None, scale_by_freq=None, mode=None):
"""
Private helper implementing the common parts between the psd, csd,
spectrogram and complex, magnitude, angle, and phase spectrums.
"""
if y is None:
# if y is None use x for y
same_data = True
else:
# The checks for if y is x are so that we can use the same function to
# implement the core of psd(), csd(), and spectrogram() without doing
# extra calculations. We return the unaveraged Pxy, freqs, and t.
same_data = y is x
if Fs is None:
Fs = 2
if noverlap is None:
noverlap = 0
if detrend_func is None:
detrend_func = detrend_none
if window is None:
window = window_hanning
# if NFFT is set to None use the whole signal
if NFFT is None:
NFFT = 256
if not (0 <= noverlap < NFFT):
raise ValueError('noverlap must be less than NFFT')
if mode is None or mode == 'default':
mode = 'psd'
_api.check_in_list(
['default', 'psd', 'complex', 'magnitude', 'angle', 'phase'],
mode=mode)
if not same_data and mode != 'psd':
raise ValueError("x and y must be equal if mode is not 'psd'")
# Make sure we're dealing with a numpy array. If y and x were the same
# object to start with, keep them that way
x = np.asarray(x)
if not same_data:
y = np.asarray(y)
if sides is None or sides == 'default':
if np.iscomplexobj(x):
sides = 'twosided'
else:
sides = 'onesided'
_api.check_in_list(['default', 'onesided', 'twosided'], sides=sides)
# zero pad x and y up to NFFT if they are shorter than NFFT
if len(x) < NFFT:
n = len(x)
x = np.resize(x, NFFT)
x[n:] = 0
if not same_data and len(y) < NFFT:
n = len(y)
y = np.resize(y, NFFT)
y[n:] = 0
if pad_to is None:
pad_to = NFFT
if mode != 'psd':
scale_by_freq = False
elif scale_by_freq is None:
scale_by_freq = True
# For real x, ignore the negative frequencies unless told otherwise
if sides == 'twosided':
numFreqs = pad_to
if pad_to % 2:
freqcenter = (pad_to - 1)//2 + 1
else:
freqcenter = pad_to//2
scaling_factor = 1.
elif sides == 'onesided':
if pad_to % 2:
numFreqs = (pad_to + 1)//2
else:
numFreqs = pad_to//2 + 1
scaling_factor = 2.
if not np.iterable(window):
window = window(np.ones(NFFT, x.dtype))
if len(window) != NFFT:
raise ValueError(
"The window length must match the data's first dimension")
if sys.maxsize > 2**32:
result = np.lib.stride_tricks.sliding_window_view(
x, NFFT, axis=0)[::NFFT - noverlap].T
else:
# The NumPy version on 32-bit will OOM, so use old implementation.
result = _stride_windows(x, NFFT, noverlap=noverlap)
result = detrend(result, detrend_func, axis=0)
result = result * window.reshape((-1, 1))
result = np.fft.fft(result, n=pad_to, axis=0)[:numFreqs, :]
freqs = np.fft.fftfreq(pad_to, 1/Fs)[:numFreqs]
if not same_data:
# if same_data is False, mode must be 'psd'
if sys.maxsize > 2**32:
resultY = np.lib.stride_tricks.sliding_window_view(
y, NFFT, axis=0)[::NFFT - noverlap].T
else:
# The NumPy version on 32-bit will OOM, so use old implementation.
resultY = _stride_windows(y, NFFT, noverlap=noverlap)
resultY = detrend(resultY, detrend_func, axis=0)
resultY = resultY * window.reshape((-1, 1))
resultY = np.fft.fft(resultY, n=pad_to, axis=0)[:numFreqs, :]
result = np.conj(result) * resultY
elif mode == 'psd':
result = np.conj(result) * result
elif mode == 'magnitude':
result = np.abs(result) / window.sum()
elif mode == 'angle' or mode == 'phase':
# we unwrap the phase later to handle the onesided vs. twosided case
result = np.angle(result)
elif mode == 'complex':
result /= window.sum()
if mode == 'psd':
# Also include scaling factors for one-sided densities and dividing by
# the sampling frequency, if desired. Scale everything, except the DC
# component and the NFFT/2 component:
# if we have an even number of frequencies, don't scale NFFT/2
if not NFFT % 2:
slc = slice(1, -1, None)
# if we have an odd number, just don't scale DC
else:
slc = slice(1, None, None)
result[slc] *= scaling_factor
# MATLAB divides by the sampling frequency so that density function
# has units of dB/Hz and can be integrated by the plotted frequency
# values. Perform the same scaling here.
if scale_by_freq:
result /= Fs
# Scale the spectrum by the norm of the window to compensate for
# windowing loss; see Bendat & Piersol Sec 11.5.2.
result /= (window**2).sum()
else:
# In this case, preserve power in the segment, not amplitude
result /= window.sum()**2
t = np.arange(NFFT/2, len(x) - NFFT/2 + 1, NFFT - noverlap)/Fs
if sides == 'twosided':
# center the frequency range at zero
freqs = np.roll(freqs, -freqcenter, axis=0)
result = np.roll(result, -freqcenter, axis=0)
elif not pad_to % 2:
# get the last value correctly, it is negative otherwise
freqs[-1] *= -1
# we unwrap the phase here to handle the onesided vs. twosided case
if mode == 'phase':
result = np.unwrap(result, axis=0)
return result, freqs, t
def _single_spectrum_helper(
mode, x, Fs=None, window=None, pad_to=None, sides=None):
"""
Private helper implementing the commonality between the complex, magnitude,
angle, and phase spectrums.
"""
_api.check_in_list(['complex', 'magnitude', 'angle', 'phase'], mode=mode)
if pad_to is None:
pad_to = len(x)
spec, freqs, _ = _spectral_helper(x=x, y=None, NFFT=len(x), Fs=Fs,
detrend_func=detrend_none, window=window,
noverlap=0, pad_to=pad_to,
sides=sides,
scale_by_freq=False,
mode=mode)
if mode != 'complex':
spec = spec.real
if spec.ndim == 2 and spec.shape[1] == 1:
spec = spec[:, 0]
return spec, freqs
# Split out these keyword docs so that they can be used elsewhere
_docstring.interpd.register(
Spectral="""\
Fs : float, default: 2
The sampling frequency (samples per time unit). It is used to calculate
the Fourier frequencies, *freqs*, in cycles per time unit.
window : callable or ndarray, default: `.window_hanning`
A function or a vector of length *NFFT*. To create window vectors see
`.window_hanning`, `.window_none`, `numpy.blackman`, `numpy.hamming`,
`numpy.bartlett`, `scipy.signal`, `scipy.signal.get_window`, etc. If a
function is passed as the argument, it must take a data segment as an
argument and return the windowed version of the segment.
sides : {'default', 'onesided', 'twosided'}, optional
Which sides of the spectrum to return. 'default' is one-sided for real
data and two-sided for complex data. 'onesided' forces the return of a
one-sided spectrum, while 'twosided' forces two-sided.""",
Single_Spectrum="""\
pad_to : int, optional
The number of points to which the data segment is padded when performing
the FFT. While not increasing the actual resolution of the spectrum (the
minimum distance between resolvable peaks), this can give more points in
the plot, allowing for more detail. This corresponds to the *n* parameter
in the call to `~numpy.fft.fft`. The default is None, which sets *pad_to*
equal to the length of the input signal (i.e. no padding).""",
PSD="""\
pad_to : int, optional
The number of points to which the data segment is padded when performing
the FFT. This can be different from *NFFT*, which specifies the number
of data points used. While not increasing the actual resolution of the
spectrum (the minimum distance between resolvable peaks), this can give
more points in the plot, allowing for more detail. This corresponds to
the *n* parameter in the call to `~numpy.fft.fft`. The default is None,
which sets *pad_to* equal to *NFFT*
NFFT : int, default: 256
The number of data points used in each block for the FFT. A power 2 is
most efficient. This should *NOT* be used to get zero padding, or the
scaling of the result will be incorrect; use *pad_to* for this instead.
detrend : {'none', 'mean', 'linear'} or callable, default: 'none'
The function applied to each segment before fft-ing, designed to remove
the mean or linear trend. Unlike in MATLAB, where the *detrend* parameter
is a vector, in Matplotlib it is a function. The :mod:`~matplotlib.mlab`
module defines `.detrend_none`, `.detrend_mean`, and `.detrend_linear`,
but you can use a custom function as well. You can also use a string to
choose one of the functions: 'none' calls `.detrend_none`. 'mean' calls
`.detrend_mean`. 'linear' calls `.detrend_linear`.
scale_by_freq : bool, default: True
Whether the resulting density values should be scaled by the scaling
frequency, which gives density in units of 1/Hz. This allows for
integration over the returned frequency values. The default is True for
MATLAB compatibility.""")
@_docstring.interpd
def psd(x, NFFT=None, Fs=None, detrend=None, window=None,
noverlap=None, pad_to=None, sides=None, scale_by_freq=None):
r"""
Compute the power spectral density.
The power spectral density :math:`P_{xx}` by Welch's average
periodogram method. The vector *x* is divided into *NFFT* length
segments. Each segment is detrended by function *detrend* and
windowed by function *window*. *noverlap* gives the length of
the overlap between segments. The :math:`|\mathrm{fft}(i)|^2`
of each segment :math:`i` are averaged to compute :math:`P_{xx}`.
If len(*x*) < *NFFT*, it will be zero padded to *NFFT*.
Parameters
----------
x : 1-D array or sequence
Array or sequence containing the data
%(Spectral)s
%(PSD)s
noverlap : int, default: 0 (no overlap)
The number of points of overlap between segments.
Returns
-------
Pxx : 1-D array
The values for the power spectrum :math:`P_{xx}` (real valued)
freqs : 1-D array
The frequencies corresponding to the elements in *Pxx*
References
----------
Bendat & Piersol -- Random Data: Analysis and Measurement Procedures, John
Wiley & Sons (1986)
See Also
--------
specgram
`specgram` differs in the default overlap; in not returning the mean of
the segment periodograms; and in returning the times of the segments.
magnitude_spectrum : returns the magnitude spectrum.
csd : returns the spectral density between two signals.
"""
Pxx, freqs = csd(x=x, y=None, NFFT=NFFT, Fs=Fs, detrend=detrend,
window=window, noverlap=noverlap, pad_to=pad_to,
sides=sides, scale_by_freq=scale_by_freq)
return Pxx.real, freqs
@_docstring.interpd
def csd(x, y, NFFT=None, Fs=None, detrend=None, window=None,
noverlap=None, pad_to=None, sides=None, scale_by_freq=None):
"""
Compute the cross-spectral density.
The cross spectral density :math:`P_{xy}` by Welch's average
periodogram method. The vectors *x* and *y* are divided into
*NFFT* length segments. Each segment is detrended by function
*detrend* and windowed by function *window*. *noverlap* gives
the length of the overlap between segments. The product of
the direct FFTs of *x* and *y* are averaged over each segment
to compute :math:`P_{xy}`, with a scaling to correct for power
loss due to windowing.
If len(*x*) < *NFFT* or len(*y*) < *NFFT*, they will be zero
padded to *NFFT*.
Parameters
----------
x, y : 1-D arrays or sequences
Arrays or sequences containing the data
%(Spectral)s
%(PSD)s
noverlap : int, default: 0 (no overlap)
The number of points of overlap between segments.
Returns
-------
Pxy : 1-D array
The values for the cross spectrum :math:`P_{xy}` before scaling (real
valued)
freqs : 1-D array
The frequencies corresponding to the elements in *Pxy*
References
----------
Bendat & Piersol -- Random Data: Analysis and Measurement Procedures, John
Wiley & Sons (1986)
See Also
--------
psd : equivalent to setting ``y = x``.
"""
if NFFT is None:
NFFT = 256
Pxy, freqs, _ = _spectral_helper(x=x, y=y, NFFT=NFFT, Fs=Fs,
detrend_func=detrend, window=window,
noverlap=noverlap, pad_to=pad_to,
sides=sides, scale_by_freq=scale_by_freq,
mode='psd')
if Pxy.ndim == 2:
if Pxy.shape[1] > 1:
Pxy = Pxy.mean(axis=1)
else:
Pxy = Pxy[:, 0]
return Pxy, freqs
_single_spectrum_docs = """\
Compute the {quantity} of *x*.
Data is padded to a length of *pad_to* and the windowing function *window* is
applied to the signal.
Parameters
----------
x : 1-D array or sequence
Array or sequence containing the data
{Spectral}
{Single_Spectrum}
Returns
-------
spectrum : 1-D array
The {quantity}.
freqs : 1-D array
The frequencies corresponding to the elements in *spectrum*.
See Also
--------
psd
Returns the power spectral density.
complex_spectrum
Returns the complex-valued frequency spectrum.
magnitude_spectrum
Returns the absolute value of the `complex_spectrum`.
angle_spectrum
Returns the angle of the `complex_spectrum`.
phase_spectrum
Returns the phase (unwrapped angle) of the `complex_spectrum`.
specgram
Can return the complex spectrum of segments within the signal.
"""
complex_spectrum = functools.partial(_single_spectrum_helper, "complex")
complex_spectrum.__doc__ = _single_spectrum_docs.format(
quantity="complex-valued frequency spectrum",
**_docstring.interpd.params)
magnitude_spectrum = functools.partial(_single_spectrum_helper, "magnitude")
magnitude_spectrum.__doc__ = _single_spectrum_docs.format(
quantity="magnitude (absolute value) of the frequency spectrum",
**_docstring.interpd.params)
angle_spectrum = functools.partial(_single_spectrum_helper, "angle")
angle_spectrum.__doc__ = _single_spectrum_docs.format(
quantity="angle of the frequency spectrum (wrapped phase spectrum)",
**_docstring.interpd.params)
phase_spectrum = functools.partial(_single_spectrum_helper, "phase")
phase_spectrum.__doc__ = _single_spectrum_docs.format(
quantity="phase of the frequency spectrum (unwrapped phase spectrum)",
**_docstring.interpd.params)
@_docstring.interpd
def specgram(x, NFFT=None, Fs=None, detrend=None, window=None,
noverlap=None, pad_to=None, sides=None, scale_by_freq=None,
mode=None):
"""
Compute a spectrogram.
Compute and plot a spectrogram of data in *x*. Data are split into
*NFFT* length segments and the spectrum of each section is
computed. The windowing function *window* is applied to each
segment, and the amount of overlap of each segment is
specified with *noverlap*.
Parameters
----------
x : array-like
1-D array or sequence.
%(Spectral)s
%(PSD)s
noverlap : int, default: 128
The number of points of overlap between blocks.
mode : str, default: 'psd'
What sort of spectrum to use:
'psd'
Returns the power spectral density.
'complex'
Returns the complex-valued frequency spectrum.
'magnitude'
Returns the magnitude spectrum.
'angle'
Returns the phase spectrum without unwrapping.
'phase'
Returns the phase spectrum with unwrapping.
Returns
-------
spectrum : array-like
2D array, columns are the periodograms of successive segments.
freqs : array-like
1-D array, frequencies corresponding to the rows in *spectrum*.
t : array-like
1-D array, the times corresponding to midpoints of segments
(i.e the columns in *spectrum*).
See Also
--------
psd : differs in the overlap and in the return values.
complex_spectrum : similar, but with complex valued frequencies.
magnitude_spectrum : similar single segment when *mode* is 'magnitude'.
angle_spectrum : similar to single segment when *mode* is 'angle'.
phase_spectrum : similar to single segment when *mode* is 'phase'.
Notes
-----
*detrend* and *scale_by_freq* only apply when *mode* is set to 'psd'.
"""
if noverlap is None:
noverlap = 128 # default in _spectral_helper() is noverlap = 0
if NFFT is None:
NFFT = 256 # same default as in _spectral_helper()
if len(x) <= NFFT:
_api.warn_external("Only one segment is calculated since parameter "
f"NFFT (={NFFT}) >= signal length (={len(x)}).")
spec, freqs, t = _spectral_helper(x=x, y=None, NFFT=NFFT, Fs=Fs,
detrend_func=detrend, window=window,
noverlap=noverlap, pad_to=pad_to,
sides=sides,
scale_by_freq=scale_by_freq,
mode=mode)
if mode != 'complex':
spec = spec.real # Needed since helper implements generically
return spec, freqs, t
@_docstring.interpd
def cohere(x, y, NFFT=256, Fs=2, detrend=detrend_none, window=window_hanning,
noverlap=0, pad_to=None, sides='default', scale_by_freq=None):
r"""
The coherence between *x* and *y*. Coherence is the normalized
cross spectral density:
.. math::
C_{xy} = \frac{|P_{xy}|^2}{P_{xx}P_{yy}}
Parameters
----------
x, y
Array or sequence containing the data
%(Spectral)s
%(PSD)s
noverlap : int, default: 0 (no overlap)
The number of points of overlap between segments.
Returns
-------
Cxy : 1-D array
The coherence vector.
freqs : 1-D array
The frequencies for the elements in *Cxy*.
See Also
--------
:func:`psd`, :func:`csd` :
For information about the methods used to compute :math:`P_{xy}`,
:math:`P_{xx}` and :math:`P_{yy}`.
"""
if len(x) < 2 * NFFT:
raise ValueError(
"Coherence is calculated by averaging over *NFFT* length "
"segments. Your signal is too short for your choice of *NFFT*.")
Pxx, f = psd(x, NFFT, Fs, detrend, window, noverlap, pad_to, sides,
scale_by_freq)
Pyy, f = psd(y, NFFT, Fs, detrend, window, noverlap, pad_to, sides,
scale_by_freq)
Pxy, f = csd(x, y, NFFT, Fs, detrend, window, noverlap, pad_to, sides,
scale_by_freq)
Cxy = np.abs(Pxy) ** 2 / (Pxx * Pyy)
return Cxy, f
class GaussianKDE:
"""
Representation of a kernel-density estimate using Gaussian kernels.
Parameters
----------
dataset : array-like
Datapoints to estimate from. In case of univariate data this is a 1-D
array, otherwise a 2D array with shape (# of dims, # of data).
bw_method : {'scott', 'silverman'} or float or callable, optional
The method used to calculate the estimator bandwidth. If a
float, this will be used directly as `!kde.factor`. If a
callable, it should take a `GaussianKDE` instance as only
parameter and return a float. If None (default), 'scott' is used.
Attributes
----------
dataset : ndarray
The dataset passed to the constructor.
dim : int
Number of dimensions.
num_dp : int
Number of datapoints.
factor : float
The bandwidth factor, obtained from `~GaussianKDE.covariance_factor`, with which
the covariance matrix is multiplied.
covariance : ndarray
The covariance matrix of *dataset*, scaled by the calculated bandwidth
(`!kde.factor`).
inv_cov : ndarray
The inverse of *covariance*.
Methods
-------
kde.evaluate(points) : ndarray
Evaluate the estimated pdf on a provided set of points.
kde(points) : ndarray
Same as kde.evaluate(points)
"""
# This implementation with minor modification was too good to pass up.
# from scipy: https://github.com/scipy/scipy/blob/master/scipy/stats/kde.py
def __init__(self, dataset, bw_method=None):
self.dataset = np.atleast_2d(dataset)
if not np.array(self.dataset).size > 1:
raise ValueError("`dataset` input should have multiple elements.")
self.dim, self.num_dp = np.array(self.dataset).shape
if bw_method is None:
pass
elif cbook._str_equal(bw_method, 'scott'):
self.covariance_factor = self.scotts_factor
elif cbook._str_equal(bw_method, 'silverman'):
self.covariance_factor = self.silverman_factor
elif isinstance(bw_method, Number):
self._bw_method = 'use constant'
self.covariance_factor = lambda: bw_method
elif callable(bw_method):
self._bw_method = bw_method
self.covariance_factor = lambda: self._bw_method(self)
else:
raise ValueError("`bw_method` should be 'scott', 'silverman', a "
"scalar or a callable")
# Computes the covariance matrix for each Gaussian kernel using
# covariance_factor().
self.factor = self.covariance_factor()
# Cache covariance and inverse covariance of the data
if not hasattr(self, '_data_inv_cov'):
self.data_covariance = np.atleast_2d(
np.cov(
self.dataset,
rowvar=1,
bias=False))
self.data_inv_cov = np.linalg.inv(self.data_covariance)
self.covariance = self.data_covariance * self.factor ** 2
self.inv_cov = self.data_inv_cov / self.factor ** 2
self.norm_factor = (np.sqrt(np.linalg.det(2 * np.pi * self.covariance))
* self.num_dp)
def scotts_factor(self):
return np.power(self.num_dp, -1. / (self.dim + 4))
def silverman_factor(self):
return np.power(
self.num_dp * (self.dim + 2.0) / 4.0, -1. / (self.dim + 4))
# Default method to calculate bandwidth, can be overwritten by subclass
covariance_factor = scotts_factor
def evaluate(self, points):
"""
Evaluate the estimated pdf on a set of points.
Parameters
----------
points : (# of dimensions, # of points)-array
Alternatively, a (# of dimensions,) vector can be passed in and
treated as a single point.
Returns
-------
(# of points,)-array
The values at each point.
Raises
------
ValueError : if the dimensionality of the input points is different
than the dimensionality of the KDE.
"""
points = np.atleast_2d(points)
dim, num_m = np.array(points).shape
if dim != self.dim:
raise ValueError(f"points have dimension {dim}, dataset has "
f"dimension {self.dim}")
result = np.zeros(num_m)
if num_m >= self.num_dp:
# there are more points than data, so loop over data
for i in range(self.num_dp):
diff = self.dataset[:, i, np.newaxis] - points
tdiff = np.dot(self.inv_cov, diff)
energy = np.sum(diff * tdiff, axis=0) / 2.0
result = result + np.exp(-energy)
else:
# loop over points
for i in range(num_m):
diff = self.dataset - points[:, i, np.newaxis]
tdiff = np.dot(self.inv_cov, diff)
energy = np.sum(diff * tdiff, axis=0) / 2.0
result[i] = np.sum(np.exp(-energy), axis=0)
result = result / self.norm_factor
return result
__call__ = evaluate