source: sasview/src/sas/sascalc/corfunc/transform_thread.py @ a309667

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Last change on this file since a309667 was a309667, checked in by lewis, 7 years ago

Tidy up IDF code

  • Property mode set to 100644
File size: 3.6 KB
Line 
1from sas.sascalc.data_util.calcthread import CalcThread
2from sas.sascalc.dataloader.data_info import Data1D
3from scipy.fftpack import dct
4from scipy.integrate import trapz
5import numpy as np
6from time import sleep
7
8class FourierThread(CalcThread):
9    def __init__(self, raw_data, extrapolated_data, bg, updatefn=None,
10        completefn=None):
11        CalcThread.__init__(self, updatefn=updatefn, completefn=completefn)
12        self.data = raw_data
13        self.background = bg
14        self.extrapolation = extrapolated_data
15
16    def check_if_cancelled(self):
17        if self.isquit():
18            self.update("Fourier transform cancelled.")
19            self.complete(transforms=None)
20            return True
21        return False
22
23    def compute(self):
24        qs = self.extrapolation.x
25        iqs = self.extrapolation.y
26        q = self.data.x
27        background = self.background
28
29        xs = np.pi*np.arange(len(qs),dtype=np.float32)/(q[1]-q[0])/len(qs)
30
31        self.ready(delay=0.0)
32        self.update(msg="Fourier transform in progress.")
33        self.ready(delay=0.0)
34
35        if self.check_if_cancelled(): return
36        try:
37            # ----- 1D Correlation Function -----
38            gamma1 = dct((iqs-background)*qs**2)
39            Q = gamma1.max()
40            gamma1 /= Q
41
42            if self.check_if_cancelled(): return
43
44            # ----- 3D Correlation Function -----
45            # gamma3(R) = 1/R int_{0}^{R} gamma1(x) dx
46            # trapz uses the trapezium rule to calculate the integral
47            mask = xs <= 200.0 # Only calculate gamma3 up to x=200 (as this is all that's plotted)
48            gamma3 = [trapz(gamma1[:n], xs[:n])/xs[n-1] for n in range(2, len(xs[mask]) + 1)]
49            gamma3.insert(0, 1.0) # Gamma_3(0) is defined as 1
50            gamma3 = np.array(gamma3)
51
52            if self.check_if_cancelled(): return
53
54            # ----- Interface Distribution function -----
55            idf = dct(-qs**4 * (iqs-background))
56
57            if self.check_if_cancelled(): return
58
59            # Manually calculate IDF(0.0), since scipy DCT tends to give us a
60            # very large negative value.
61            # IDF(x) = int_0^inf q^4 * I(q) * cos(q*x) * dq
62            # => IDF(0) = int_0^inf q^4 * I(q) * dq
63            idf[0] = trapz(-qs**4 * (iqs-background), qs)
64            idf /= Q # Normalise using scattering invariant
65
66        except Exception as e:
67            import logging
68            logger = logging.getLogger(__name__)
69            logger.error(e)
70
71            self.update(msg="Fourier transform failed.")
72            self.complete(transforms=None)
73            return
74        if self.isquit():
75            return
76        self.update(msg="Fourier transform completed.")
77
78        transform1 = Data1D(xs, gamma1)
79        transform3 = Data1D(xs[xs <= 200], gamma3)
80        idf = Data1D(xs, idf)
81
82        transforms = (transform1, transform3, idf)
83
84        self.complete(transforms=transforms)
85
86class HilbertThread(CalcThread):
87    def __init__(self, raw_data, extrapolated_data, bg, updatefn=None,
88        completefn=None):
89        CalcThread.__init__(self, updatefn=updatefn, completefn=completefn)
90        self.data = raw_data
91        self.background = bg
92        self.extrapolation = extrapolated_data
93
94    def compute(self):
95        qs = self.extrapolation.x
96        iqs = self.extrapolation.y
97        q = self.data.x
98        background = self.background
99
100        self.ready(delay=0.0)
101        self.update(msg="Starting Hilbert transform.")
102        self.ready(delay=0.0)
103        if self.isquit():
104            return
105
106        # TODO: Implement hilbert transform
107
108        self.update(msg="Hilbert transform completed.")
109
110        self.complete(transforms=None)
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