[339ce67] | 1 | #!/usr/bin/env python |
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| 2 | |
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| 3 | ############################################################################## |
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| 4 | # This software was developed by the University of Tennessee as part of the |
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| 5 | # Distributed Data Analysis of Neutron Scattering Experiments (DANSE) |
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| 6 | # project funded by the US National Science Foundation. |
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| 7 | # |
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| 8 | # If you use DANSE applications to do scientific research that leads to |
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| 9 | # publication, we ask that you acknowledge the use of the software with the |
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| 10 | # following sentence: |
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| 11 | # |
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| 12 | # "This work benefited from DANSE software developed under NSF award DMR-0520547." |
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| 13 | # |
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| 14 | # copyright 2008, University of Tennessee |
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| 15 | ############################################################################## |
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| 16 | |
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| 17 | |
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| 18 | """ |
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| 19 | Provide functionality for a C extension model |
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| 20 | |
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| 21 | :WARNING: THIS FILE WAS GENERATED BY WRAPPERGENERATOR.PY |
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| 22 | DO NOT MODIFY THIS FILE, MODIFY ..\c_extensions\barbell.h |
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| 23 | AND RE-RUN THE GENERATOR SCRIPT |
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| 24 | |
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| 25 | """ |
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| 26 | |
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| 27 | from sans.models.BaseComponent import BaseComponent |
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| 28 | from sans_extension.c_models import CBarBellModel |
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| 29 | import copy |
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[96656e3] | 30 | |
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| 31 | def create_BarBellModel(): |
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| 32 | obj = BarBellModel() |
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| 33 | #CBarBellModel.__init__(obj) is called by BarBellModel constructor |
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| 34 | return obj |
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| 35 | |
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[339ce67] | 36 | class BarBellModel(CBarBellModel, BaseComponent): |
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| 37 | """ |
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| 38 | Class that evaluates a BarBellModel model. |
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| 39 | This file was auto-generated from ..\c_extensions\barbell.h. |
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| 40 | Refer to that file and the structure it contains |
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| 41 | for details of the model. |
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| 42 | List of default parameters: |
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| 43 | scale = 1.0 |
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| 44 | rad_bar = 20.0 [A] |
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| 45 | len_bar = 400.0 [A] |
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| 46 | rad_bell = 40.0 [A] |
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| 47 | sld_barbell = 1e-006 [1/A^(2)] |
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| 48 | sld_solv = 6.3e-006 [1/A^(2)] |
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| 49 | background = 0.0 [1/cm] |
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[4628e31] | 50 | theta = 0.0 [deg] |
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| 51 | phi = 0.0 [deg] |
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[339ce67] | 52 | |
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| 53 | """ |
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| 54 | |
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| 55 | def __init__(self): |
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| 56 | """ Initialization """ |
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| 57 | |
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| 58 | # Initialize BaseComponent first, then sphere |
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| 59 | BaseComponent.__init__(self) |
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[96656e3] | 60 | #apply(CBarBellModel.__init__, (self,)) |
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[339ce67] | 61 | CBarBellModel.__init__(self) |
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| 62 | |
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| 63 | ## Name of the model |
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| 64 | self.name = "BarBellModel" |
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| 65 | ## Model description |
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| 66 | self.description ="""Calculates the scattering from a barbell-shaped cylinder. That is |
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| 67 | a sphereocylinder with spherical end caps |
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| 68 | that have a radius larger than that of |
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| 69 | the cylinder and the center of the end cap |
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| 70 | radius lies outside of the cylinder. |
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| 71 | Note: As the length of cylinder(bar) -->0, |
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| 72 | it becomes a dumbbell. |
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| 73 | And when rad_bar = rad_bell, |
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| 74 | it is a spherocylinder. |
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| 75 | It must be that rad_bar <(=) rad_bell. |
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| 76 | [Parameters]; |
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| 77 | scale: volume fraction of spheres, |
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| 78 | background:incoherent background, |
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| 79 | rad_bar: radius of the cylindrical bar, |
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| 80 | len_bar: length of the cylindrical bar, |
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| 81 | rad_bell: radius of the spherical bell, |
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| 82 | sld_barbell: SLD of the barbell, |
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| 83 | sld_solv: SLD of the solvent.""" |
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| 84 | |
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| 85 | ## Parameter details [units, min, max] |
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| 86 | self.details = {} |
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| 87 | self.details['scale'] = ['', None, None] |
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| 88 | self.details['rad_bar'] = ['[A]', None, None] |
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| 89 | self.details['len_bar'] = ['[A]', None, None] |
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| 90 | self.details['rad_bell'] = ['[A]', None, None] |
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| 91 | self.details['sld_barbell'] = ['[1/A^(2)]', None, None] |
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| 92 | self.details['sld_solv'] = ['[1/A^(2)]', None, None] |
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| 93 | self.details['background'] = ['[1/cm]', None, None] |
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[4628e31] | 94 | self.details['theta'] = ['[deg]', None, None] |
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| 95 | self.details['phi'] = ['[deg]', None, None] |
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[339ce67] | 96 | |
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| 97 | ## fittable parameters |
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| 98 | self.fixed=['rad_bar.width', 'len_bar', 'rad_bell', 'phi.width', 'theta.width'] |
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| 99 | |
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| 100 | ## non-fittable parameters |
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[96656e3] | 101 | self.non_fittable = [] |
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[339ce67] | 102 | |
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| 103 | ## parameters with orientation |
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[96656e3] | 104 | self.orientation_params = ['phi', 'theta', 'phi.width', 'theta.width'] |
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[c7a7e1b] | 105 | |
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| 106 | def __setstate__(self, state): |
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| 107 | """ |
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| 108 | restore the state of a model from pickle |
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| 109 | """ |
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| 110 | self.__dict__, self.params, self.dispersion = state |
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| 111 | |
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[96656e3] | 112 | def __reduce_ex__(self, proto): |
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[339ce67] | 113 | """ |
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[96656e3] | 114 | Overwrite the __reduce_ex__ of PyTypeObject *type call in the init of |
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| 115 | c model. |
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[339ce67] | 116 | """ |
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[c7a7e1b] | 117 | state = (self.__dict__, self.params, self.dispersion) |
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| 118 | return (create_BarBellModel,tuple(), state, None, None) |
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[339ce67] | 119 | |
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[96656e3] | 120 | def clone(self): |
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| 121 | """ Return a identical copy of self """ |
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| 122 | return self._clone(BarBellModel()) |
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[339ce67] | 123 | |
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| 124 | |
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| 125 | def run(self, x=0.0): |
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| 126 | """ |
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| 127 | Evaluate the model |
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| 128 | |
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| 129 | :param x: input q, or [q,phi] |
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| 130 | |
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| 131 | :return: scattering function P(q) |
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| 132 | |
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| 133 | """ |
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| 134 | |
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| 135 | return CBarBellModel.run(self, x) |
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| 136 | |
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| 137 | def runXY(self, x=0.0): |
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| 138 | """ |
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| 139 | Evaluate the model in cartesian coordinates |
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| 140 | |
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| 141 | :param x: input q, or [qx, qy] |
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| 142 | |
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| 143 | :return: scattering function P(q) |
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| 144 | |
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| 145 | """ |
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| 146 | |
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| 147 | return CBarBellModel.runXY(self, x) |
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| 148 | |
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| 149 | def evalDistribution(self, x=[]): |
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| 150 | """ |
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| 151 | Evaluate the model in cartesian coordinates |
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| 152 | |
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| 153 | :param x: input q[], or [qx[], qy[]] |
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| 154 | |
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| 155 | :return: scattering function P(q[]) |
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| 156 | |
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| 157 | """ |
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| 158 | return CBarBellModel.evalDistribution(self, x) |
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| 159 | |
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| 160 | def calculate_ER(self): |
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| 161 | """ |
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| 162 | Calculate the effective radius for P(q)*S(q) |
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| 163 | |
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| 164 | :return: the value of the effective radius |
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| 165 | |
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| 166 | """ |
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| 167 | return CBarBellModel.calculate_ER(self) |
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| 168 | |
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| 169 | def set_dispersion(self, parameter, dispersion): |
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| 170 | """ |
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| 171 | Set the dispersion object for a model parameter |
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| 172 | |
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| 173 | :param parameter: name of the parameter [string] |
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| 174 | :param dispersion: dispersion object of type DispersionModel |
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| 175 | |
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| 176 | """ |
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| 177 | return CBarBellModel.set_dispersion(self, parameter, dispersion.cdisp) |
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| 178 | |
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| 179 | |
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| 180 | # End of file |
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