How to specify derivative for SymPy custom function? - python

I am using sympy to help automate the process of finding equations of motion for some systems using the Euler Lagrange method. What would really make this easy is if I could define a function q and specify its time derivative qd --> d/dt(q) = qd. Likewise I'd like to specify d/dt(qd) = qdd. This is helpful because as part of the process of finding the equations of motion, I need to take derivatives (with respect to time, q, and qd) of expressions that are functions of q and qd. In the end I'll end up with an equation in terms of q, qd, and qdd and I'd like to be able to either print this neatly or use lambdify to convert this to a neat numpy function for use in a simulation.
Currently I've accomplished this is a very roundabout and annoying way by defining q as a function and qd as the derivative of that function:
q = sympy.Function('q', real=True)(t)
q_diff = diff(q,t)
This is fine for most of the process but then I end up with a messy expression filled with "Derivative (q, t)" and "Derivative (Derivative(q, t), t)" which is hard to wrangle into a neat printing format and difficult to turn into a numpy function using lambdify. My current solution is thus to use the subs function and replace q_diff and diff(q_diff, t) with sympy symbols qd and qdd respectively, which cleans things up and makes manipulating the expression much easier. This seems like a bad hack though and takes tons of time to do for more complicated equations with lots of state variables.
What I'd like is to define a function, q, with a specific value for the time derivative. I'd pass in that value when creating the function, and sympy could treat it like a generic Function object but would use whatever I'd given it for the time derivative instead of just saying "Derivative(q, t)". I'd like something like this:
qdd = sympy.symbols('qdd')
qd = my_func(name='qd', time_deriv=qdd)
q = my_func(name='q', time_deriv=qd)
diff(q, t)
>>> qd
diff(q**2, t)
>>> 2*q*qd
diff(diff(q**2, t))
>>> 2*q*qdd + 2*qd**2
expr = q*qd**2
expr.subs(q, 5)
>>> 5*qd**2
Something like that, where I could still use the subs command and lambdify command to substitute numeric values for q and qd, would be extremely helpful. I've been trying to do this but I don't understand enough of how the base sympy.Function class works to get this going. This is what I have right now:
class func(sp.Function):
def __init__(self, name, deriv):
self.deriv = deriv
self.name = name
def diff(self, *args, **kwargs):
return self.deriv
def fdiff(self, argindex=1):
assert argindex == 1
return self.deriv
This code so far does not really work, I don't know how to specify that specifically the time derivative of q is qd. Right now all derivatives of q are returning q?
I don't know if this is just a really bad solution, if I should be avoiding this issue entirely, or if there's already a clean way to solve this. Any advice would be very appreciated.

Related

How to change the domain (i.e. polynomial ring) using sympy in Pytho?

I'm in the middle of a big (and frankly quite hard) project so while this is my first interrogation, it probably won't be the last. Also : english is not my first langage so 'Sorry for bad english' and I'm writing this on my phone so 'Sorry for bad formating'.
Ok so : I'm trying to implement the General Number Field Sieve in Python, and I'm, at least for now, heavily relying on sympy.
Here is a peice of code where I'm struggling. In the code below, gpc(N,m) is a float list.
From sympy import Poly
From sympy.abc import x
g = Poly(gpc(N,m), x) [*]
However, when I do that, I get a polynomial over the domain RR and I would very much like to switch this to another domain D (where D will end up being ZZ['x'] but I would like this function to be general)
I'm aware of the fact that I can slightly modify [*] in
g = Poly(gpc(N,m), x, domain = D)
to get what I want. However, this wouldn't be enough. Somewhere else in my code, I need to be able to change the domain of an already constructed polynomial, and this solution wouldn't help.
When I lookep it up, I found the change_ring method so I tried this :
f = g.change_ring(D)
However, upon execution, I get the error message :
'Poly' object has no attribute 'change_ring'
So I guess that this function don't exist.
Does anyone knows how to change the domain of a polynomial ?
Thanks a lot !
It looks like creating a new Poly instance is the best approach; there are a few class methods that could help (take a look at the Poly.from_* class methods)
For example:
from sympy import Poly
from sympy.abc import x, a
g = Poly(x**3 + a*x*2 - 5*x + 6, x)
print(g) # Poly(x**3 + (2*a - 5)*x + 6, x, domain='ZZ[a]')
f = Poly.from_poly(g, *g.gens, domain='ZZ[a, b]')
print(f) # Poly(x**3 + (2*a - 5)*x + 6, x, domain='ZZ[a,b]')
I also wonder if rationalizing your floats at some point might help - see e.g. nsimplify.

python dblquad invalid callable

I am trying to approximate the Gauss Linking integral for two straight lines in R^3 using dblquad. I've created this pair of lines as an object.
I have a form for the integrand in parametrisation variables s and t generated by a function gaussint(self,s,t) and this is working. I'm then just trying to define a function which returns the double integral over the two intervals [0,1].
Edit - the code for the function looks like this:
def gaussint(self,s,t):
formnum = self.newlens()[0]*self.newlens()[1]*np.sin(test.angle())*np.cos(test.angle())
formdenone = (np.cos(test.angle())**2)*(t*(self.newlens()[0]) - s*(self.newlens()[1]) + self.adists()[0] - self.adists()[1])**2
formdentwo = (np.sin(test.angle())**2)*(t*(self.newlens()[0]) + s*(self.newlens()[1]) + self.adists()[0] + self.adists()[1])**2
fullden = (4 + formdenone + formdentwo)**(3/2)
fullform = formnum/fullden
return fullform
The various other function calls here are just bits of linear algebra - lengths of lines, angle between them and so forth. s and t have been defined as symbols upstream, if they need to be.
The code for the integration then just looks like this (I've separated it out just to try and work out what was going on:
def approxint(self, s, t):
from scipy.integrate import dblquad
return dblquad(self.gaussint(s,t),0,1, lambda t:0,lambda t:1)
Running it gets me a lengthy bit of somewhat impenetrable process messages, followed by
ValueError: invalid callable given
Any idea where I'm going wrong?
Cheers.

How to monitor the process of SciPy.odeint?

SciPy can solve ode equations by scipy.integrate.odeint or other packages, but it gives result after the function has been solved completely. However, if the ode function is very complex, the program will take a lot of time(one or two days) to give the whole result. So how can I mointor the step it solve the equations(print out result when the equation hasn't been solved completely)?
When I was googling for an answer, I couldn't find a satisfactory one. So I made a simple gist with a proof-of-concept solution using the tqdm project. Hope that helps you.
Edit: Moderators asked me to give an explanation of what is going on in the link above.
First of all, I am using scipy's OOP version of odeint (solve_ivp) but you could adapt it back to odeint. Say you want to integrate from time T0 to T1 and you want to show progress for every 0.1% of progress. You can modify your ode function to take two extra parameters, a pbar (progress bar) and a state (current state of integration). Like so:
def fun(t, y, omega, pbar, state):
# state is a list containing last updated time t:
# state = [last_t, dt]
# I used a list because its values can be carried between function
# calls throughout the ODE integration
last_t, dt = state
# let's subdivide t_span into 1000 parts
# call update(n) here where n = (t - last_t) / dt
time.sleep(0.1)
n = int((t - last_t)/dt)
pbar.update(n)
# we need this to take into account that n is a rounded number.
state[0] = last_t + dt * n
# YOUR CODE HERE
dydt = 1j * y * omega
return dydt
This is necessary because the function itself must know where it is located, but scipy's odeint doesn't really give this context to the function. Then, you can integrate fun with the following code:
T0 = 0
T1 = 1
t_span = (T0, T1)
omega = 20
y0 = np.array([1], dtype=np.complex)
t_eval = np.arange(*t_span, 0.25/omega)
with tqdm(total=1000, unit="‰") as pbar:
sol = solve_ivp(
fun,
t_span,
y0,
t_eval=t_eval,
args=[omega, pbar, [T0, (T1-T0)/1000]],
)
Note that anything mutable (like a list) in the args is instantiated once and can be changed from within the function. I recommend doing this rather than using a global variable.
This will show a progress bar that looks like this:
100%|█████████▉| 999/1000 [00:13<00:00, 71.69‰/s]
You could split the integration domain and integrate the segments, taking the last value of the previous as initial condition of the next segment. In-between, print out whatever you want. Use numpy.concatenate to assemble the pieces if necessary.
In a standard example of a 3-body solar system simulation, replacing the code
u0 = solsys.getState0();
t = np.arange(0, 100*365.242*day, 0.5*day);
%timeit u_res = odeint(lambda u,t: solsys.getDerivs(u), u0, t, atol = 1e11*1e-8, rtol = 1e-9)
output: 1 loop, best of 3: 5.53 s per loop
with a progress-reporting code
def progressive(t,N):
nk = [ int(n+0.5) for n in np.linspace(0,len(t),N+1) ]
u0 = solsys.getState0();
u_seg = [ np.array([u0]) ];
for k in range(N):
u_seg.append( odeint(lambda u,t: solsys.getDerivs(u), u0, t[nk[k]:nk[k+1]], atol = 1e11*1e-8, rtol = 1e-9)[1:] )
print t[nk[k]]/day
for b in solsys.bodies: print("%10s %s"%(b.name,b.x))
return np.concatenate(u_seg)
%timeit u_res = progressive(t,20)
output: 1 loop, best of 3: 5.96 s per loop
shows only a slight 8% overhead for console printing. With a more substantive ODE function, the fraction of the reporting overhead will reduce significantly.
That said, python, at least with its standard packages, is not the tool for industrial-scale number-crunching. Always use compiled versions with strong typing of variables to reduce interpretative overhead as much as possible.
Use some heavily developed and tested package like Sundials or the julia-lang framework differentialequations.jl directly coding the ODE function in an appropriate compiled language. Use the higher-order methods for larger step sizes, thus smaller steps. Test if using implicit or exponential/Rosenbrock methods reduces the number of steps or ODE function evaluations per fixed interval further. The difference can be a factor of 10 to 100 in speedup.
Use a python wrapper of the above with some acceleration-friendly implementation of your ODE function.
Use the quasi-source-translating tool JITcode to translate your python ODE function to a spaghetti list of C instruction that then give a compiled function that can be (almost) directly called from the compiled FORTRAN kernel of odeint.
Simple and Clear.
If you want to integrate an ODE from T0 to T1:
In the last line of the code, before return, you can use print((t/T1)*100,end='')
Then use a sys.stdout.flush() to keep the same line of printing.
Here is an example. My integrating time [0 0.2]
ddt[-2]=(beta/(Ap2*(L-x)))*(-Qgap+Ap*u)
ddt[-1]=(beta/(Ap2*(L+x)))*(Qgap-Ap*u)
print("\rCompletion percentage "+str(format(((t/0.2)*100),".4f")),end='')
sys.stdout.flush()
return ddt
It slows a bit the solving process by fraction of seconds, but it serves perfectly the purpose rather than creating new functions.

Approximating Numerical 2nd Derivative with Python

To preface this question, I understand that it could be done better. But this is a question in a class of mine and I must approach it this way. We cannot use any built in functions or packages.
I need to write a function to approximate the numerical value of the second derivative of a given function using finite difference. The function is below we are using.
2nd Derivative Formula (I lost the login info to my old account so pardon my lack of points and not being able to include images).
My question is this:
I don't understand how to make the python function accept the input function it is to be deriving. If someone puts in the input 2nd_deriv(2x**2 + 4, 6) I dont understand how to evaluate 2x^2 at 6.
If this is unclear, let me know and I can try again to describe. Python is new to me so I am just getting my feet wet.
Thanks
you can pass the function as any other "variable":
def f(x):
return 2*x*x + 4
def d2(fn, x0, h):
return (fn(x0+h) - 2*fn(x0) + fn(x0-h))/(h*h)
print(d2(f, 6, 0.1))
you can't pass a literal expression, you need a function (or a lambda).
def d2(f, x0, h = 1e-9):
func = f
if isinstance(f, str):
# quite insecure, use only with controlled input
func = eval ("lambda x:%s" % (f,))
return (func(x0+h) - 2*func(x0) + func(x0-h))/(2*h)
Then to use it
def g(x):
return 2*x**2 + 4
# using explicit function, forcing h value
print d2(g, 6, 1e-10)
Or directly:
# using lambda and default value for h
print d2(lambda x:2x**2+4, 6)
EDIT
updated to take into account that f can be a string or a function

rewriting python scipy.integrate.odeint to mimic matlab ode15s

I am new to python, and would like to mimic using the matlab ode15s in python instead of the built-in odeint from scipy.
The code originally is written like this:
newRphi = odeint(PSP,Rphi,t,(b,k,F))[-1,:]
where PSP is defined as:
def PSP(xx,t,b,k,F):
R = xx[0]
phi = xx[1]
Rdot = sum([b[i]*R**(i+1) for i in xrange(len(b))]) + F(t) #indexing from zero
phiDot = 2*pi * k[2]*((R/k[1])**k[0])
yy = hstack((Rdot,phiDot))
return(yy)
from reading the instructions on scipy.integrate.odeint(), this function takes arguments in the following format:
scipy.integrate.odeint(func, y0, t, args=())
which means that func=PSP, y0=Rphi, t=t, args=(b,k,f)
So Rphi goes into PSP function, and gets integrated and becomes yy and comes out, and this function does it repeatedly for every element of t.
Now I want to translate it into something that would mimic ode15s from matlab. From reading some other treads, I found out that I can do that using
ode.set_integrator('vode', method='bdf', order=15)
Now the question becomes, how do I pass the original arguments to this integrator?
I am thinking it would probably look something like this:
ode15s = scipy.integrate.ode(f)
ode15s.set_integrator('vode', method='bdf', order=15)
ode15s.set_initial_value(y0, t0)
I know that the f is my PSP function, y0 is still the same: Rphi,
Here are my questions:
what is my initial value for t0, is it just t[0]?
how do I pass the variables (b,k,f) to the function f=PSP?
when I call this ode15s, how do I integrate through the vector size of t and collect the final values for yy?
Any help would be greatly appreciated. Thank you.

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