1 | #!/usr/bin/env python |
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2 | """ |
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3 | This software was developed by the University of Tennessee as part of the |
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4 | Distributed Data Analysis of Neutron Scattering Experiments (DANSE) |
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5 | project funded by the US National Science Foundation. |
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6 | |
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7 | If you use DANSE applications to do scientific research that leads to |
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8 | publication, we ask that you acknowledge the use of the software with the |
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9 | following sentence: |
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10 | |
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11 | "This work benefited from DANSE software developed under NSF award DMR-0520547." |
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12 | |
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13 | copyright 2008, University of Tennessee |
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14 | """ |
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15 | |
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16 | """ Provide functionality for a C extension model |
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17 | |
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18 | WARNING: THIS FILE WAS GENERATED BY WRAPPERGENERATOR.PY |
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19 | DO NOT MODIFY THIS FILE, MODIFY ..\c_extensions\corefourshell.h |
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20 | AND RE-RUN THE GENERATOR SCRIPT |
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21 | |
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22 | """ |
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23 | |
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24 | from sans.models.BaseComponent import BaseComponent |
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25 | from sans_extension.c_models import CCoreFourShellModel |
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26 | import copy |
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27 | |
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28 | class CoreFourShellModel(CCoreFourShellModel, BaseComponent): |
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29 | """ Class that evaluates a CoreFourShellModel model. |
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30 | This file was auto-generated from ..\c_extensions\corefourshell.h. |
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31 | Refer to that file and the structure it contains |
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32 | for details of the model. |
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33 | List of default parameters: |
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34 | scale = 1.0 |
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35 | rad_core = 60.0 [A] |
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36 | sld_core = 6.4e-006 [1/A^(2)] |
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37 | thick_shell1 = 10.0 [A] |
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38 | sld_shell1 = 1e-006 [1/A^(2)] |
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39 | thick_shell2 = 10.0 [A] |
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40 | sld_shell2 = 2e-006 [1/A^(2)] |
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41 | thick_shell3 = 10.0 [A] |
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42 | sld_shell3 = 3e-006 [1/A^(2)] |
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43 | thick_shell4 = 10.0 [A] |
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44 | sld_shell4 = 4e-006 [1/A^(2)] |
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45 | sld_solv = 6.4e-006 [1/A^(2)] |
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46 | background = 0.001 [1/cm] |
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47 | |
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48 | """ |
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49 | |
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50 | def __init__(self): |
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51 | """ Initialization """ |
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52 | |
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53 | # Initialize BaseComponent first, then sphere |
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54 | BaseComponent.__init__(self) |
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55 | CCoreFourShellModel.__init__(self) |
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56 | |
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57 | ## Name of the model |
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58 | self.name = "CoreFourShellModel" |
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59 | ## Model description |
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60 | self.description =""" Calculates the scattering intensity from a core-4 shell structure. |
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61 | scale = scale factor * volume fraction |
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62 | rad_core: the radius of the core |
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63 | sld_core: the SLD of the core |
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64 | thick_shelli: the thickness of the i'th shell from the core |
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65 | sld_shelli: the SLD of the i'th shell from the core |
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66 | sld_solv: the SLD of the solvent |
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67 | background: incoherent background""" |
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68 | |
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69 | ## Parameter details [units, min, max] |
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70 | self.details = {} |
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71 | self.details['scale'] = ['', None, None] |
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72 | self.details['rad_core'] = ['[A]', None, None] |
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73 | self.details['sld_core'] = ['[1/A^(2)]', None, None] |
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74 | self.details['thick_shell1'] = ['[A]', None, None] |
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75 | self.details['sld_shell1'] = ['[1/A^(2)]', None, None] |
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76 | self.details['thick_shell2'] = ['[A]', None, None] |
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77 | self.details['sld_shell2'] = ['[1/A^(2)]', None, None] |
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78 | self.details['thick_shell3'] = ['[A]', None, None] |
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79 | self.details['sld_shell3'] = ['[1/A^(2)]', None, None] |
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80 | self.details['thick_shell4'] = ['[A]', None, None] |
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81 | self.details['sld_shell4'] = ['[1/A^(2)]', None, None] |
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82 | self.details['sld_solv'] = ['[1/A^(2)]', None, None] |
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83 | self.details['background'] = ['[1/cm]', None, None] |
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84 | |
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85 | ## fittable parameters |
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86 | self.fixed=['thick_shell4.width', 'thick_shell1.width', 'thick_shell2.width', 'thick_shell3.width', 'rad_core.width'] |
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87 | |
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88 | ## parameters with orientation |
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89 | self.orientation_params =[] |
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90 | |
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91 | def clone(self): |
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92 | """ Return a identical copy of self """ |
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93 | return self._clone(CoreFourShellModel()) |
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94 | |
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95 | def __getstate__(self): |
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96 | """ return object state for pickling and copying """ |
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97 | model_state = {'params': self.params, 'dispersion': self.dispersion, 'log': self.log} |
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98 | |
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99 | return self.__dict__, model_state |
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100 | |
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101 | def __setstate__(self, state): |
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102 | """ create object from pickled state """ |
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103 | |
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104 | self.__dict__, model_state = state |
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105 | self.params = model_state['params'] |
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106 | self.dispersion = model_state['dispersion'] |
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107 | self.log = model_state['log'] |
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108 | |
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109 | |
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110 | def run(self, x = 0.0): |
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111 | """ Evaluate the model |
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112 | @param x: input q, or [q,phi] |
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113 | @return: scattering function P(q) |
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114 | """ |
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115 | |
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116 | return CCoreFourShellModel.run(self, x) |
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117 | |
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118 | def runXY(self, x = 0.0): |
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119 | """ Evaluate the model in cartesian coordinates |
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120 | @param x: input q, or [qx, qy] |
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121 | @return: scattering function P(q) |
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122 | """ |
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123 | |
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124 | return CCoreFourShellModel.runXY(self, x) |
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125 | |
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126 | def evalDistribution(self, x = []): |
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127 | """ Evaluate the model in cartesian coordinates |
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128 | @param x: input q[], or [qx[], qy[]] |
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129 | @return: scattering function P(q[]) |
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130 | """ |
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131 | return CCoreFourShellModel.evalDistribution(self, x) |
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132 | |
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133 | def calculate_ER(self): |
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134 | """ Calculate the effective radius for P(q)*S(q) |
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135 | @return: the value of the effective radius |
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136 | """ |
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137 | return CCoreFourShellModel.calculate_ER(self) |
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138 | |
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139 | def set_dispersion(self, parameter, dispersion): |
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140 | """ |
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141 | Set the dispersion object for a model parameter |
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142 | @param parameter: name of the parameter [string] |
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143 | @dispersion: dispersion object of type DispersionModel |
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144 | """ |
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145 | return CCoreFourShellModel.set_dispersion(self, parameter, dispersion.cdisp) |
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146 | |
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147 | |
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148 | # End of file |
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