/
scipy.py
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/
scipy.py
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# Licensed under a 3-clause BSD style license - see LICENSE.rst
import numpy as np
import scipy.optimize
from gammapy.utils.interpolation import interpolate_profile
from gammapy.utils.roots import find_roots
from .likelihood import Likelihood
__all__ = [
"confidence_scipy",
"covariance_scipy",
"optimize_scipy",
"stat_profile_ul_scipy",
]
def optimize_scipy(parameters, function, store_trace=False, **kwargs):
method = kwargs.pop("method", "Nelder-Mead")
pars = [par.factor for par in parameters.free_parameters]
bounds = []
for par in parameters.free_parameters:
parmin = par.factor_min if not np.isnan(par.factor_min) else None
parmax = par.factor_max if not np.isnan(par.factor_max) else None
bounds.append((parmin, parmax))
likelihood = Likelihood(function, parameters, store_trace)
result = scipy.optimize.minimize(
likelihood.fcn, pars, bounds=bounds, method=method, **kwargs
)
factors = result.x
info = {
"success": result.success,
"message": result.message,
"nfev": result.nfev,
"trace": likelihood.trace,
}
optimizer = None
return factors, info, optimizer
class TSDifference:
"""Fit statistic function wrapper to compute TS differences."""
def __init__(self, function, parameters, parameter, reoptimize, ts_diff):
self.stat_null = function()
self.parameters = parameters
self.function = function
self.parameter = parameter
self.ts_diff = ts_diff
self.reoptimize = reoptimize
def fcn(self, factor):
self.parameter.factor = factor
if self.reoptimize:
self.parameter.frozen = True
optimize_scipy(self.parameters, self.function, method="L-BFGS-B")
value = self.function() - self.stat_null - self.ts_diff
return value
def _confidence_scipy_brentq(
parameters, parameter, function, sigma, reoptimize, upper=True, **kwargs
):
ts_diff = TSDifference(
function, parameters, parameter, reoptimize, ts_diff=sigma**2
)
lower_bound = parameter.factor
if upper:
upper_bound = parameter.conf_max / parameter.scale
else:
upper_bound = parameter.conf_min / parameter.scale
message, success = "Confidence terminated successfully.", True
kwargs.setdefault("nbin", 1)
roots, res = find_roots(
ts_diff.fcn, lower_bound=lower_bound, upper_bound=upper_bound, **kwargs
)
result = (roots[0], res[0])
if np.isnan(roots[0]):
message = (
"Confidence estimation failed. Try to set the parameter.min/max by hand."
)
success = False
suffix = "errp" if upper else "errn"
return {
"nfev_" + suffix: result[1].iterations,
suffix: np.abs(result[0] - lower_bound),
"success_" + suffix: success,
"message_" + suffix: message,
"stat_null": ts_diff.stat_null,
}
def confidence_scipy(parameters, parameter, function, sigma, reoptimize=True, **kwargs):
if len(parameters.free_parameters) <= 1:
reoptimize = False
with parameters.restore_status():
result = _confidence_scipy_brentq(
parameters=parameters,
parameter=parameter,
function=function,
sigma=sigma,
upper=False,
reoptimize=reoptimize,
**kwargs,
)
with parameters.restore_status():
result_errp = _confidence_scipy_brentq(
parameters=parameters,
parameter=parameter,
function=function,
sigma=sigma,
upper=True,
reoptimize=reoptimize,
**kwargs,
)
result.update(result_errp)
return result
# TODO: implement, e.g. with numdifftools.Hessian
def covariance_scipy(parameters, function):
raise NotImplementedError
def stat_profile_ul_scipy(
value_scan, stat_scan, delta_ts=4, interp_scale="sqrt", **kwargs
):
"""Compute upper limit of a parameter from a likelihood profile.
Parameters
----------
value_scan : `~numpy.ndarray`
Array of parameter values.
stat_scan : `~numpy.ndarray`
Array of delta fit statistic values, with respect to the minimum.
delta_ts : float, optional
Difference in test statistics for the upper limit. Default is 4.
interp_scale : {"sqrt", "lin"}, optional
Interpolation scale applied to the fit statistic profile. If the profile is
of parabolic shape, a "sqrt" scaling is recommended. In other cases or
for fine sampled profiles a "lin" can also be used. Default is "sqrt".
**kwargs : dict
Keyword arguments passed to `~scipy.optimize.brentq`.
Returns
-------
ul : float
Upper limit value.
"""
interp = interpolate_profile(value_scan, stat_scan, interp_scale=interp_scale)
def f(x):
return interp((x,)) - delta_ts
idx = np.argmin(stat_scan)
norm_best_fit = value_scan[idx]
roots, res = find_roots(
f, lower_bound=norm_best_fit, upper_bound=value_scan[-1], nbin=1, **kwargs
)
return roots[0]