[5068697] | 1 | #!/usr/bin/env python |
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| 2 | |
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[79ac6f8] | 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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[5068697] | 16 | |
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| 17 | |
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[79ac6f8] | 18 | """ |
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| 19 | Provide functionality for a C extension model |
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[5068697] | 20 | |
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[79ac6f8] | 21 | :WARNING: THIS FILE WAS GENERATED BY WRAPPERGENERATOR.PY |
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[b1c3295] | 22 | DO NOT MODIFY THIS FILE, MODIFY ../c_extensions/triaxial_ellipsoid.h |
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[79ac6f8] | 23 | AND RE-RUN THE GENERATOR SCRIPT |
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[5068697] | 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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[92df66f8] | 28 | from sans.models.sans_extension.c_models import CTriaxialEllipsoidModel |
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[5068697] | 29 | import copy |
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[96656e3] | 30 | |
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| 31 | def create_TriaxialEllipsoidModel(): |
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| 32 | obj = TriaxialEllipsoidModel() |
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| 33 | #CTriaxialEllipsoidModel.__init__(obj) is called by TriaxialEllipsoidModel constructor |
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| 34 | return obj |
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| 35 | |
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[5068697] | 36 | class TriaxialEllipsoidModel(CTriaxialEllipsoidModel, BaseComponent): |
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[79ac6f8] | 37 | """ |
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| 38 | Class that evaluates a TriaxialEllipsoidModel model. |
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[b1c3295] | 39 | This file was auto-generated from ../c_extensions/triaxial_ellipsoid.h. |
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[79ac6f8] | 40 | Refer to that file and the structure it contains |
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| 41 | for details of the model. |
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[b1c3295] | 42 | List of default parameters: |
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| 43 | scale = 1.0 |
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| 44 | semi_axisA = 35.0 [A] |
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| 45 | semi_axisB = 100.0 [A] |
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| 46 | semi_axisC = 400.0 [A] |
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| 47 | sldEll = 1e-06 [1/A^(2)] |
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| 48 | sldSolv = 6.3e-06 [1/A^(2)] |
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| 49 | background = 0.0 [1/cm] |
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| 50 | axis_theta = 57.325 [deg] |
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| 51 | axis_phi = 57.325 [deg] |
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| 52 | axis_psi = 0.0 [deg] |
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[5068697] | 53 | |
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| 54 | """ |
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| 55 | |
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| 56 | def __init__(self): |
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| 57 | """ Initialization """ |
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| 58 | |
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| 59 | # Initialize BaseComponent first, then sphere |
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| 60 | BaseComponent.__init__(self) |
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[96656e3] | 61 | #apply(CTriaxialEllipsoidModel.__init__, (self,)) |
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[5068697] | 62 | CTriaxialEllipsoidModel.__init__(self) |
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| 63 | |
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| 64 | ## Name of the model |
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| 65 | self.name = "TriaxialEllipsoidModel" |
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| 66 | ## Model description |
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[b1c3295] | 67 | self.description ="""Note: During fitting ensure that the inequality A<B<C is not |
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| 68 | violated. Otherwise the calculation will |
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[7ad9887] | 69 | not be correct.""" |
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[5068697] | 70 | |
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[b1c3295] | 71 | ## Parameter details [units, min, max] |
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| 72 | self.details = {} |
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| 73 | self.details['scale'] = ['', None, None] |
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| 74 | self.details['semi_axisA'] = ['[A]', None, None] |
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| 75 | self.details['semi_axisB'] = ['[A]', None, None] |
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| 76 | self.details['semi_axisC'] = ['[A]', None, None] |
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| 77 | self.details['sldEll'] = ['[1/A^(2)]', None, None] |
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| 78 | self.details['sldSolv'] = ['[1/A^(2)]', None, None] |
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| 79 | self.details['background'] = ['[1/cm]', None, None] |
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| 80 | self.details['axis_theta'] = ['[deg]', None, None] |
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| 81 | self.details['axis_phi'] = ['[deg]', None, None] |
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| 82 | self.details['axis_psi'] = ['[deg]', None, None] |
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[5068697] | 83 | |
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[fe9c19b4] | 84 | ## fittable parameters |
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[975ec8e] | 85 | self.fixed=['axis_psi.width', 'axis_phi.width', 'axis_theta.width', 'semi_axisA.width', 'semi_axisB.width', 'semi_axisC.width'] |
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[5068697] | 86 | |
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[35aface] | 87 | ## non-fittable parameters |
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[96656e3] | 88 | self.non_fittable = [] |
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[35aface] | 89 | |
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[5068697] | 90 | ## parameters with orientation |
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[96656e3] | 91 | self.orientation_params = ['axis_psi', 'axis_phi', 'axis_theta', 'axis_psi.width', 'axis_phi.width', 'axis_theta.width'] |
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[c7a7e1b] | 92 | |
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| 93 | def __setstate__(self, state): |
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| 94 | """ |
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| 95 | restore the state of a model from pickle |
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| 96 | """ |
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| 97 | self.__dict__, self.params, self.dispersion = state |
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| 98 | |
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[96656e3] | 99 | def __reduce_ex__(self, proto): |
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[79ac6f8] | 100 | """ |
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[96656e3] | 101 | Overwrite the __reduce_ex__ of PyTypeObject *type call in the init of |
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| 102 | c model. |
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[79ac6f8] | 103 | """ |
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[c7a7e1b] | 104 | state = (self.__dict__, self.params, self.dispersion) |
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| 105 | return (create_TriaxialEllipsoidModel,tuple(), state, None, None) |
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[fe9c19b4] | 106 | |
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[96656e3] | 107 | def clone(self): |
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| 108 | """ Return a identical copy of self """ |
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| 109 | return self._clone(TriaxialEllipsoidModel()) |
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[fe9c19b4] | 110 | |
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[5068697] | 111 | |
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[79ac6f8] | 112 | def run(self, x=0.0): |
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| 113 | """ |
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| 114 | Evaluate the model |
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| 115 | |
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| 116 | :param x: input q, or [q,phi] |
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| 117 | |
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| 118 | :return: scattering function P(q) |
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| 119 | |
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[5068697] | 120 | """ |
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| 121 | |
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| 122 | return CTriaxialEllipsoidModel.run(self, x) |
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| 123 | |
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[79ac6f8] | 124 | def runXY(self, x=0.0): |
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| 125 | """ |
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| 126 | Evaluate the model in cartesian coordinates |
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| 127 | |
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| 128 | :param x: input q, or [qx, qy] |
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| 129 | |
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| 130 | :return: scattering function P(q) |
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| 131 | |
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[5068697] | 132 | """ |
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| 133 | |
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| 134 | return CTriaxialEllipsoidModel.runXY(self, x) |
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| 135 | |
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[79ac6f8] | 136 | def evalDistribution(self, x=[]): |
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| 137 | """ |
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| 138 | Evaluate the model in cartesian coordinates |
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| 139 | |
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| 140 | :param x: input q[], or [qx[], qy[]] |
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| 141 | |
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| 142 | :return: scattering function P(q[]) |
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| 143 | |
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[9bd69098] | 144 | """ |
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[f9a1279] | 145 | return CTriaxialEllipsoidModel.evalDistribution(self, x) |
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[9bd69098] | 146 | |
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[5eb9154] | 147 | def calculate_ER(self): |
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[79ac6f8] | 148 | """ |
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| 149 | Calculate the effective radius for P(q)*S(q) |
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| 150 | |
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| 151 | :return: the value of the effective radius |
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| 152 | |
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[5eb9154] | 153 | """ |
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| 154 | return CTriaxialEllipsoidModel.calculate_ER(self) |
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| 155 | |
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[5068697] | 156 | def set_dispersion(self, parameter, dispersion): |
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| 157 | """ |
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[79ac6f8] | 158 | Set the dispersion object for a model parameter |
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| 159 | |
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| 160 | :param parameter: name of the parameter [string] |
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| 161 | :param dispersion: dispersion object of type DispersionModel |
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| 162 | |
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[5068697] | 163 | """ |
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| 164 | return CTriaxialEllipsoidModel.set_dispersion(self, parameter, dispersion.cdisp) |
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| 165 | |
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| 166 | |
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[b1c3295] | 167 | # End of file |
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