RPA10Model.py @ 84cbaae

ESS_GUIESS_GUI_DocsESS_GUI_batch_fittingESS_GUI_bumps_abstractionESS_GUI_iss1116ESS_GUI_iss879ESS_GUI_iss959ESS_GUI_openclESS_GUI_orderingESS_GUI_sync_sascalccostrafo411magnetic_scattrelease-4.1.1release-4.1.2release-4.2.2release_4.0.1ticket-1009ticket-1094-headlessticket-1242-2d-resolutionticket-1243ticket-1249ticket885unittest-saveload

Last change on this file since 84cbaae was 79492222, checked in by krzywon, 10 years ago
Changed the file and folder names to remove all SANS references.
Property mode set to `100644`
File size: 9.6 KB

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1
2	from sas.models.BaseComponent import BaseComponent
3	from sas.models.RPAModel import RPAModel
4	from copy import deepcopy
5	max_case_n = 10
6	class RPA10Model(BaseComponent):
7	"""
8	This multi-model is based on Parratt formalism and provides the capability
9	of changing the number of layers between 0 and 10.
10	"""
11	def __init__(self, multfactor=1):
12	BaseComponent.__init__(self)
13	"""
14	:param multfactor: number of cases in the model, assumes 0<= case# <=10.
15	"""
16
17	## Setting model name model description
18	self.description=""
19	model = RPAModel()
20	self.model = model
21	self.name = "RPA10Model"
22	self.description=model.description
23	self.case_num = multfactor
24	## Define parameters
25	self.params = {}
26
27	## Parameter details [units, min, max]
28	self.details = {}
29
30	# non-fittable parameters
31	self.non_fittable = model.non_fittable
32
33	# list of function in order of the function number
34	self.fun_list = self._get_func_list()
35	## dispersion
36	self._set_dispersion()
37	## Define parameters
38	self._set_params()
39
40	## Parameter details [units, min, max]
41	self._set_details()
42
43	#list of parameter that can be fitted
44	self._set_fixed_params()
45	self.model.params['lcase_n'] = self.case_num
46
47	## functional multiplicity of the model
48	self.multiplicity_info = [max_case_n,"Case No.:",["C/D Binary Mixture of Homopolymers",
49	"C-D Diblock Copolymer",
50	"B/C/D Ternary Mixture of Homopolymers",
51	"B/C-D Mixture of Homopolymer B and Diblock Copolymer C-D",
52	"B-C-D Triblock Copolymer",
53	"A/B/C/D Quaternary Mixture of Homopolymers",
54	"A/B/C-D Mixture of Homopolymer A/B and Diblock C-D",
55	"A/B-C-D Mixture of Homopolymer A and triblock B-C-D",
56	"A-B/C-D Mixture of Diblock Copolymer A-B and Diblock C-D",
57	"A-B-C-D Four-block Copolymer"],
58	[]]
59
60	def _clone(self, obj):
61	"""
62	Internal utility function to copy the internal
63	data members to a fresh copy.
64	"""
65	obj.params = deepcopy(self.params)
66	obj.non_fittable = deepcopy(self.non_fittable)
67	obj.description = deepcopy(self.description)
68	obj.details = deepcopy(self.details)
69	obj.dispersion = deepcopy(self.dispersion)
70	obj.model = self.model.clone()
71
72	return obj
73
74
75	def _set_dispersion(self):
76	"""
77	model dispersions
78	"""
79	##set dispersion from model
80	self.dispersion = {}
81
82
83	def _set_params(self):
84	"""
85	Concatenate the parameters of the model to create
86	this model parameters
87	"""
88	# set the case number first
89	self.model.params['lcase_n'] = self.case_num
90	# rearrange the parameters for the given # of shells
91	for name , value in self.model.params.iteritems():
92	if name == 'lcase_n':
93	continue
94	elif name.lower() == 'scale' or \
95	name.lower() == 'background':
96	self.params[name] = value
97	elif self.case_num <= 1:
98	if name.lower() == 'nc' or \
99	name.lower() == 'phic' or \
100	name.lower() == 'vc' or \
101	name.lower() == 'lc' or \
102	name.lower() == 'bc' or \
103	name.lower() == 'nd' or \
104	name.lower() == 'phid' or \
105	name.lower() == 'vd' or \
106	name.lower() == 'ld' or \
107	name.lower() == 'bd' or \
108	name.lower() == 'kcd':
109	self.params[name] = value
110	elif self.case_num > 1 and self.case_num <= 4:
111	if name.lower() == 'nb' or \
112	name.lower() == 'phib' or \
113	name.lower() == 'vb' or \
114	name.lower() == 'lb' or \
115	name.lower() == 'bb' or \
116	name.lower() == 'nc' or \
117	name.lower() == 'phic' or \
118	name.lower() == 'vc' or \
119	name.lower() == 'lc' or \
120	name.lower() == 'bc' or \
121	name.lower() == 'nd' or \
122	name.lower() == 'phid' or \
123	name.lower() == 'vd' or \
124	name.lower() == 'ld' or \
125	name.lower() == 'bd' or \
126	name.lower() == 'kbc' or \
127	name.lower() == 'kbd' or \
128	name.lower() == 'kcd' :
129	self.params[name] = value
130	else:
131	if name.lower() == 'na' or \
132	name.lower() == 'phia' or \
133	name.lower() == 'va' or \
134	name.lower() == 'la' or \
135	name.lower() == 'ba' or \
136	name.lower() == 'nb' or \
137	name.lower() == 'phib' or \
138	name.lower() == 'vb' or \
139	name.lower() == 'lb' or \
140	name.lower() == 'bb' or \
141	name.lower() == 'nc' or \
142	name.lower() == 'phic' or \
143	name.lower() == 'vc' or \
144	name.lower() == 'lc' or \
145	name.lower() == 'bc' or \
146	name.lower() == 'nd' or \
147	name.lower() == 'phid' or \
148	name.lower() == 'vd' or \
149	name.lower() == 'ld' or \
150	name.lower() == 'bd' or \
151	name.lower() == 'kab' or \
152	name.lower() == 'kac' or \
153	name.lower() == 'kad' or \
154	name.lower() == 'kbc' or \
155	name.lower() == 'kbd' or \
156	name.lower() == 'kcd' :
157	self.params[name] = value
158
159
160
161	def _set_details(self):
162	"""
163	Concatenate details of the original model to create
164	this model details
165	"""
166	for name ,detail in self.model.details.iteritems():
167	if name in self.params.iterkeys():
168	self.details[name]= detail
169
170	def _get_func_list(self):
171	"""
172	Get the list of functions in each cases
173	"""
174	func_list = {}
175	return func_list
176
177	def getProfile(self):
178	"""
179	Get SLD profile
180
181	: return: None, No SLD profile supporting for this model
182	"""
183	return None
184
185	def setParam(self, name, value):
186	"""
187	Set the value of a model parameter
188
189	: param name: name of the parameter
190	: param value: value of the parameter
191	"""
192	# set param to new model
193	self._setParamHelper( name, value)
194
195	self.model.setParam( name, value)
196
197	def _setParamHelper(self, name, value):
198	"""
199	Helper function to setParam
200	"""
201
202	# Look for standard parameter
203	for item in self.params.keys():
204	if item.lower()==name.lower():
205	self.params[item] = value
206	return
207
208	raise ValueError, "Model does not contain parameter %s" % name
209
210
211	def _set_fixed_params(self):
212	"""
213	Fill the self.fixed list with the model fixed list
214	"""
215	pass
216
217	def run(self, x = 0.0):
218	"""
219	Evaluate the model
220
221	:param x: input q, or [q,phi]
222
223	:return: scattering function P(q)
224
225	"""
226
227	return self.model.run(x)
228
229	def runXY(self, x = 0.0):
230	"""
231	Evaluate the model
232
233	: param x: input q-value (float or [float, float] as [qx, qy])
234	: return: scattering function value
235	"""
236
237	return self.model.runXY(x)
238
239	## Now (May27,10) directly uses the model eval function
240	## instead of the for-loop in Base Component.
241	def evalDistribution(self, x = []):
242	"""
243	Evaluate the model in cartesian coordinates
244
245	: param x: input q[], or [qx[], qy[]]
246	: return: scattering function P(q[])
247	"""
248	# set effective radius and scaling factor before run
249	return self.model.evalDistribution(x)
250	def calculate_ER(self):
251	"""
252	"""
253	return self.model.calculate_ER()
254	def set_dispersion(self, parameter, dispersion):
255	"""
256	Set the dispersion object for a model parameter
257
258	: param parameter: name of the parameter [string]
259	:dispersion: dispersion object of type DispersionModel
260	"""
261	pass

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source: sasview/src/sas/models/RPA10Model.py @ 84cbaae

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