Old engine for Continuous Time Bayesian Networks. Superseded by reCTBN. 🐍
https://github.com/madlabunimib/PyCTBN
You can not select more than 25 topics
Topics must start with a letter or number, can include dashes ('-') and can be up to 35 characters long.
189 lines
7.8 KiB
189 lines
7.8 KiB
4 years ago
|
import numpy as np
|
||
|
from scipy.integrate import ode
|
||
|
from .common import validate_tol, validate_first_step, warn_extraneous
|
||
|
from .base import OdeSolver, DenseOutput
|
||
|
|
||
|
|
||
|
class LSODA(OdeSolver):
|
||
|
"""Adams/BDF method with automatic stiffness detection and switching.
|
||
|
|
||
|
This is a wrapper to the Fortran solver from ODEPACK [1]_. It switches
|
||
|
automatically between the nonstiff Adams method and the stiff BDF method.
|
||
|
The method was originally detailed in [2]_.
|
||
|
|
||
|
Parameters
|
||
|
----------
|
||
|
fun : callable
|
||
|
Right-hand side of the system. The calling signature is ``fun(t, y)``.
|
||
|
Here ``t`` is a scalar, and there are two options for the ndarray ``y``:
|
||
|
It can either have shape (n,); then ``fun`` must return array_like with
|
||
|
shape (n,). Alternatively it can have shape (n, k); then ``fun``
|
||
|
must return an array_like with shape (n, k), i.e. each column
|
||
|
corresponds to a single column in ``y``. The choice between the two
|
||
|
options is determined by `vectorized` argument (see below). The
|
||
|
vectorized implementation allows a faster approximation of the Jacobian
|
||
|
by finite differences (required for this solver).
|
||
|
t0 : float
|
||
|
Initial time.
|
||
|
y0 : array_like, shape (n,)
|
||
|
Initial state.
|
||
|
t_bound : float
|
||
|
Boundary time - the integration won't continue beyond it. It also
|
||
|
determines the direction of the integration.
|
||
|
first_step : float or None, optional
|
||
|
Initial step size. Default is ``None`` which means that the algorithm
|
||
|
should choose.
|
||
|
min_step : float, optional
|
||
|
Minimum allowed step size. Default is 0.0, i.e., the step size is not
|
||
|
bounded and determined solely by the solver.
|
||
|
max_step : float, optional
|
||
|
Maximum allowed step size. Default is np.inf, i.e., the step size is not
|
||
|
bounded and determined solely by the solver.
|
||
|
rtol, atol : float and array_like, optional
|
||
|
Relative and absolute tolerances. The solver keeps the local error
|
||
|
estimates less than ``atol + rtol * abs(y)``. Here `rtol` controls a
|
||
|
relative accuracy (number of correct digits). But if a component of `y`
|
||
|
is approximately below `atol`, the error only needs to fall within
|
||
|
the same `atol` threshold, and the number of correct digits is not
|
||
|
guaranteed. If components of y have different scales, it might be
|
||
|
beneficial to set different `atol` values for different components by
|
||
|
passing array_like with shape (n,) for `atol`. Default values are
|
||
|
1e-3 for `rtol` and 1e-6 for `atol`.
|
||
|
jac : None or callable, optional
|
||
|
Jacobian matrix of the right-hand side of the system with respect to
|
||
|
``y``. The Jacobian matrix has shape (n, n) and its element (i, j) is
|
||
|
equal to ``d f_i / d y_j``. The function will be called as
|
||
|
``jac(t, y)``. If None (default), the Jacobian will be
|
||
|
approximated by finite differences. It is generally recommended to
|
||
|
provide the Jacobian rather than relying on a finite-difference
|
||
|
approximation.
|
||
|
lband, uband : int or None
|
||
|
Parameters defining the bandwidth of the Jacobian,
|
||
|
i.e., ``jac[i, j] != 0 only for i - lband <= j <= i + uband``. Setting
|
||
|
these requires your jac routine to return the Jacobian in the packed format:
|
||
|
the returned array must have ``n`` columns and ``uband + lband + 1``
|
||
|
rows in which Jacobian diagonals are written. Specifically
|
||
|
``jac_packed[uband + i - j , j] = jac[i, j]``. The same format is used
|
||
|
in `scipy.linalg.solve_banded` (check for an illustration).
|
||
|
These parameters can be also used with ``jac=None`` to reduce the
|
||
|
number of Jacobian elements estimated by finite differences.
|
||
|
vectorized : bool, optional
|
||
|
Whether `fun` is implemented in a vectorized fashion. A vectorized
|
||
|
implementation offers no advantages for this solver. Default is False.
|
||
|
|
||
|
Attributes
|
||
|
----------
|
||
|
n : int
|
||
|
Number of equations.
|
||
|
status : string
|
||
|
Current status of the solver: 'running', 'finished' or 'failed'.
|
||
|
t_bound : float
|
||
|
Boundary time.
|
||
|
direction : float
|
||
|
Integration direction: +1 or -1.
|
||
|
t : float
|
||
|
Current time.
|
||
|
y : ndarray
|
||
|
Current state.
|
||
|
t_old : float
|
||
|
Previous time. None if no steps were made yet.
|
||
|
nfev : int
|
||
|
Number of evaluations of the right-hand side.
|
||
|
njev : int
|
||
|
Number of evaluations of the Jacobian.
|
||
|
|
||
|
References
|
||
|
----------
|
||
|
.. [1] A. C. Hindmarsh, "ODEPACK, A Systematized Collection of ODE
|
||
|
Solvers," IMACS Transactions on Scientific Computation, Vol 1.,
|
||
|
pp. 55-64, 1983.
|
||
|
.. [2] L. Petzold, "Automatic selection of methods for solving stiff and
|
||
|
nonstiff systems of ordinary differential equations", SIAM Journal
|
||
|
on Scientific and Statistical Computing, Vol. 4, No. 1, pp. 136-148,
|
||
|
1983.
|
||
|
"""
|
||
|
def __init__(self, fun, t0, y0, t_bound, first_step=None, min_step=0.0,
|
||
|
max_step=np.inf, rtol=1e-3, atol=1e-6, jac=None, lband=None,
|
||
|
uband=None, vectorized=False, **extraneous):
|
||
|
warn_extraneous(extraneous)
|
||
|
super(LSODA, self).__init__(fun, t0, y0, t_bound, vectorized)
|
||
|
|
||
|
if first_step is None:
|
||
|
first_step = 0 # LSODA value for automatic selection.
|
||
|
else:
|
||
|
first_step = validate_first_step(first_step, t0, t_bound)
|
||
|
|
||
|
first_step *= self.direction
|
||
|
|
||
|
if max_step == np.inf:
|
||
|
max_step = 0 # LSODA value for infinity.
|
||
|
elif max_step <= 0:
|
||
|
raise ValueError("`max_step` must be positive.")
|
||
|
|
||
|
if min_step < 0:
|
||
|
raise ValueError("`min_step` must be nonnegative.")
|
||
|
|
||
|
rtol, atol = validate_tol(rtol, atol, self.n)
|
||
|
|
||
|
solver = ode(self.fun, jac)
|
||
|
solver.set_integrator('lsoda', rtol=rtol, atol=atol, max_step=max_step,
|
||
|
min_step=min_step, first_step=first_step,
|
||
|
lband=lband, uband=uband)
|
||
|
solver.set_initial_value(y0, t0)
|
||
|
|
||
|
# Inject t_bound into rwork array as needed for itask=5.
|
||
|
solver._integrator.rwork[0] = self.t_bound
|
||
|
solver._integrator.call_args[4] = solver._integrator.rwork
|
||
|
|
||
|
self._lsoda_solver = solver
|
||
|
|
||
|
def _step_impl(self):
|
||
|
solver = self._lsoda_solver
|
||
|
integrator = solver._integrator
|
||
|
|
||
|
# From lsoda.step and lsoda.integrate itask=5 means take a single
|
||
|
# step and do not go past t_bound.
|
||
|
itask = integrator.call_args[2]
|
||
|
integrator.call_args[2] = 5
|
||
|
solver._y, solver.t = integrator.run(
|
||
|
solver.f, solver.jac or (lambda: None), solver._y, solver.t,
|
||
|
self.t_bound, solver.f_params, solver.jac_params)
|
||
|
integrator.call_args[2] = itask
|
||
|
|
||
|
if solver.successful():
|
||
|
self.t = solver.t
|
||
|
self.y = solver._y
|
||
|
# From LSODA Fortran source njev is equal to nlu.
|
||
|
self.njev = integrator.iwork[12]
|
||
|
self.nlu = integrator.iwork[12]
|
||
|
return True, None
|
||
|
else:
|
||
|
return False, 'Unexpected istate in LSODA.'
|
||
|
|
||
|
def _dense_output_impl(self):
|
||
|
iwork = self._lsoda_solver._integrator.iwork
|
||
|
rwork = self._lsoda_solver._integrator.rwork
|
||
|
|
||
|
order = iwork[14]
|
||
|
h = rwork[11]
|
||
|
yh = np.reshape(rwork[20:20 + (order + 1) * self.n],
|
||
|
(self.n, order + 1), order='F').copy()
|
||
|
|
||
|
return LsodaDenseOutput(self.t_old, self.t, h, order, yh)
|
||
|
|
||
|
|
||
|
class LsodaDenseOutput(DenseOutput):
|
||
|
def __init__(self, t_old, t, h, order, yh):
|
||
|
super(LsodaDenseOutput, self).__init__(t_old, t)
|
||
|
self.h = h
|
||
|
self.yh = yh
|
||
|
self.p = np.arange(order + 1)
|
||
|
|
||
|
def _call_impl(self, t):
|
||
|
if t.ndim == 0:
|
||
|
x = ((t - self.t) / self.h) ** self.p
|
||
|
else:
|
||
|
x = ((t - self.t) / self.h) ** self.p[:, None]
|
||
|
|
||
|
return np.dot(self.yh, x)
|