[15d2285] | 1 | #!/usr/bin/env python |
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| 2 | # -*- coding: utf-8 -*- |
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| 3 | |
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| 4 | import sys |
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| 5 | from bumps.names import * |
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| 6 | from sasmodels.core import load_model |
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| 7 | from sasmodels.bumps_model import Model, Experiment |
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| 8 | from sasmodels.data import load_data, set_beam_stop, set_top |
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| 9 | |
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| 10 | """ IMPORT THE DATA USED """ |
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| 11 | radial_data = load_data('DEC07267.DAT') |
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| 12 | set_beam_stop(radial_data, 0.00669, outer=0.025) |
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| 13 | set_top(radial_data, -.0185) |
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| 14 | |
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| 15 | kernel = load_model("ellipsoid") |
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| 16 | |
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| 17 | model = Model(kernel, |
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| 18 | scale=0.08, |
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| 19 | rpolar=15, requatorial=800, |
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| 20 | sld=.291, solvent_sld=7.105, |
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| 21 | background=0, |
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| 22 | theta=90, phi=0, |
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| 23 | theta_pd=15, theta_pd_n=40, theta_pd_nsigma=3, |
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| 24 | rpolar_pd=0.222296, rpolar_pd_n=1, rpolar_pd_nsigma=0, |
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| 25 | requatorial_pd=.000128, requatorial_pd_n=1, requatorial_pd_nsigma=0, |
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| 26 | phi_pd=0, phi_pd_n=20, phi_pd_nsigma=3, |
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| 27 | ) |
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| 28 | |
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| 29 | # SET THE FITTING PARAMETERS |
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| 30 | model.rpolar.range(15, 1000) |
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| 31 | model.requatorial.range(15, 1000) |
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| 32 | model.theta_pd.range(0, 360) |
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| 33 | model.background.range(0,1000) |
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| 34 | model.scale.range(0, 10) |
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| 35 | |
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| 36 | #cutoff = 0 # no cutoff on polydisperisity loops |
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| 37 | #cutoff = 1e-5 # default cutoff |
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| 38 | cutoff = 1e-3 # low precision cutoff |
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| 39 | M = Experiment(data=radial_data, model=model, cutoff=cutoff) |
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| 40 | problem = FitProblem(M) |
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