[68aa210] | 1 | """ |
---|
| 2 | CanSAS 2D data reader for reading HDF5 formatted CanSAS files. |
---|
| 3 | """ |
---|
| 4 | |
---|
| 5 | import h5py |
---|
| 6 | import numpy as np |
---|
| 7 | import re |
---|
| 8 | import os |
---|
| 9 | import sys |
---|
| 10 | |
---|
[7b50f14] | 11 | from ..data_info import plottable_1D, plottable_2D,\ |
---|
[082239e] | 12 | Data1D, Data2D, DataInfo, Process, Aperture, Collimation, \ |
---|
| 13 | TransmissionSpectrum, Detector |
---|
[7b50f14] | 14 | from ..data_info import combine_data_info_with_plottable |
---|
| 15 | from ..loader_exceptions import FileContentsException, DefaultReaderException |
---|
| 16 | from ..file_reader_base_class import FileReader, decode |
---|
[5c5e7fd] | 17 | |
---|
| 18 | def h5attr(node, key, default=None): |
---|
| 19 | return decode(node.attrs.get(key, default)) |
---|
[68aa210] | 20 | |
---|
[9d786e5] | 21 | class Reader(FileReader): |
---|
[68aa210] | 22 | """ |
---|
[082239e] | 23 | A class for reading in CanSAS v2.0 data files. The existing iteration opens |
---|
| 24 | Mantid generated HDF5 formatted files with file extension .h5/.H5. Any |
---|
| 25 | number of data sets may be present within the file and any dimensionality |
---|
| 26 | of data may be used. Currently 1D and 2D SAS data sets are supported, but |
---|
| 27 | future implementations will include 1D and 2D SESANS data. |
---|
[d72567e] | 28 | |
---|
[082239e] | 29 | Any number of SASdata sets may be present in a SASentry and the data within |
---|
| 30 | can be either 1D I(Q) or 2D I(Qx, Qy). |
---|
[68aa210] | 31 | |
---|
[5e906207] | 32 | Also supports reading NXcanSAS formatted HDF5 files |
---|
| 33 | |
---|
[68aa210] | 34 | :Dependencies: |
---|
[d72567e] | 35 | The CanSAS HDF5 reader requires h5py => v2.5.0 or later. |
---|
[68aa210] | 36 | """ |
---|
| 37 | |
---|
[082239e] | 38 | # CanSAS version |
---|
[68aa210] | 39 | cansas_version = 2.0 |
---|
[082239e] | 40 | # Logged warnings or messages |
---|
[68aa210] | 41 | logging = None |
---|
[082239e] | 42 | # List of errors for the current data set |
---|
[68aa210] | 43 | errors = None |
---|
[082239e] | 44 | # Raw file contents to be processed |
---|
[68aa210] | 45 | raw_data = None |
---|
[082239e] | 46 | # List of plottable1D objects that should be linked to the current_datainfo |
---|
[d72567e] | 47 | data1d = None |
---|
[082239e] | 48 | # List of plottable2D objects that should be linked to the current_datainfo |
---|
[d72567e] | 49 | data2d = None |
---|
[082239e] | 50 | # Data type name |
---|
[ad52d31] | 51 | type_name = "CanSAS 2.0" |
---|
[082239e] | 52 | # Wildcards |
---|
[ad52d31] | 53 | type = ["CanSAS 2.0 HDF5 Files (*.h5)|*.h5"] |
---|
[082239e] | 54 | # List of allowed extensions |
---|
[68aa210] | 55 | ext = ['.h5', '.H5'] |
---|
[082239e] | 56 | # Flag to bypass extension check |
---|
[54544637] | 57 | allow_all = True |
---|
[68aa210] | 58 | |
---|
[9d786e5] | 59 | def get_file_contents(self): |
---|
[68aa210] | 60 | """ |
---|
[ad52d31] | 61 | This is the general read method that all SasView data_loaders must have. |
---|
[68aa210] | 62 | |
---|
| 63 | :param filename: A path for an HDF5 formatted CanSAS 2D data file. |
---|
[d72567e] | 64 | :return: List of Data1D/2D objects and/or a list of errors. |
---|
[68aa210] | 65 | """ |
---|
[082239e] | 66 | # Reinitialize when loading a new data file to reset all class variables |
---|
[d72567e] | 67 | self.reset_class_variables() |
---|
[9d786e5] | 68 | |
---|
| 69 | filename = self.f_open.name |
---|
| 70 | self.f_open.close() # IO handled by h5py |
---|
| 71 | |
---|
[082239e] | 72 | # Check that the file exists |
---|
[68aa210] | 73 | if os.path.isfile(filename): |
---|
| 74 | basename = os.path.basename(filename) |
---|
| 75 | _, extension = os.path.splitext(basename) |
---|
| 76 | # If the file type is not allowed, return empty list |
---|
| 77 | if extension in self.ext or self.allow_all: |
---|
[082239e] | 78 | # Load the data file |
---|
[7f75a3f] | 79 | try: |
---|
| 80 | self.raw_data = h5py.File(filename, 'r') |
---|
| 81 | except Exception as e: |
---|
[8dec7e7] | 82 | if extension not in self.ext: |
---|
| 83 | msg = "CanSAS2.0 HDF5 Reader could not load file {}".format(basename + extension) |
---|
| 84 | raise DefaultReaderException(msg) |
---|
| 85 | raise FileContentsException(e.message) |
---|
[dcb91cf] | 86 | try: |
---|
| 87 | # Read in all child elements of top level SASroot |
---|
| 88 | self.read_children(self.raw_data, []) |
---|
| 89 | # Add the last data set to the list of outputs |
---|
| 90 | self.add_data_set() |
---|
| 91 | except Exception as exc: |
---|
| 92 | raise FileContentsException(exc.message) |
---|
| 93 | finally: |
---|
| 94 | # Close the data file |
---|
| 95 | self.raw_data.close() |
---|
| 96 | |
---|
| 97 | for dataset in self.output: |
---|
| 98 | if isinstance(dataset, Data1D): |
---|
| 99 | if dataset.x.size < 5: |
---|
| 100 | self.output = [] |
---|
| 101 | raise FileContentsException("Fewer than 5 data points found.") |
---|
[68aa210] | 102 | |
---|
[d72567e] | 103 | def reset_class_variables(self): |
---|
| 104 | """ |
---|
| 105 | Create the reader object and define initial states for class variables |
---|
| 106 | """ |
---|
| 107 | self.current_datainfo = None |
---|
| 108 | self.current_dataset = None |
---|
| 109 | self.data1d = [] |
---|
| 110 | self.data2d = [] |
---|
| 111 | self.raw_data = None |
---|
| 112 | self.errors = set() |
---|
| 113 | self.logging = [] |
---|
| 114 | self.output = [] |
---|
| 115 | self.parent_class = u'' |
---|
| 116 | self.detector = Detector() |
---|
| 117 | self.collimation = Collimation() |
---|
| 118 | self.aperture = Aperture() |
---|
| 119 | self.process = Process() |
---|
| 120 | self.trans_spectrum = TransmissionSpectrum() |
---|
| 121 | |
---|
| 122 | def read_children(self, data, parent_list): |
---|
[68aa210] | 123 | """ |
---|
[ad52d31] | 124 | A recursive method for stepping through the hierarchical data file. |
---|
[68aa210] | 125 | |
---|
| 126 | :param data: h5py Group object of any kind |
---|
| 127 | :param parent: h5py Group parent name |
---|
| 128 | """ |
---|
| 129 | |
---|
[082239e] | 130 | # Loop through each element of the parent and process accordingly |
---|
[68aa210] | 131 | for key in data.keys(): |
---|
[082239e] | 132 | # Get all information for the current key |
---|
[68aa210] | 133 | value = data.get(key) |
---|
[7b50f14] | 134 | class_name = h5attr(value, u'canSAS_class') |
---|
| 135 | if class_name is None: |
---|
[5c5e7fd] | 136 | class_name = h5attr(value, u'NX_class') |
---|
[68aa210] | 137 | if class_name is not None: |
---|
| 138 | class_prog = re.compile(class_name) |
---|
| 139 | else: |
---|
| 140 | class_prog = re.compile(value.name) |
---|
| 141 | |
---|
| 142 | if isinstance(value, h5py.Group): |
---|
[c9ecd1b] | 143 | # Set parent class before recursion |
---|
[d72567e] | 144 | self.parent_class = class_name |
---|
| 145 | parent_list.append(key) |
---|
[082239e] | 146 | # If a new sasentry, store the current data sets and create |
---|
| 147 | # a fresh Data1D/2D object |
---|
[68aa210] | 148 | if class_prog.match(u'SASentry'): |
---|
| 149 | self.add_data_set(key) |
---|
[d72567e] | 150 | elif class_prog.match(u'SASdata'): |
---|
| 151 | self._initialize_new_data_set(parent_list) |
---|
[082239e] | 152 | # Recursion step to access data within the group |
---|
[d72567e] | 153 | self.read_children(value, parent_list) |
---|
[c9ecd1b] | 154 | # Reset parent class when returning from recursive method |
---|
| 155 | self.parent_class = class_name |
---|
[d72567e] | 156 | self.add_intermediate() |
---|
| 157 | parent_list.remove(key) |
---|
[68aa210] | 158 | |
---|
| 159 | elif isinstance(value, h5py.Dataset): |
---|
[082239e] | 160 | # If this is a dataset, store the data appropriately |
---|
[68aa210] | 161 | data_set = data[key][:] |
---|
[7bd6860a] | 162 | unit = self._get_unit(value) |
---|
[ac370c5] | 163 | |
---|
[082239e] | 164 | # I and Q Data |
---|
[7bd6860a] | 165 | if key == u'I': |
---|
[082239e] | 166 | if isinstance(self.current_dataset, plottable_2D): |
---|
[ac370c5] | 167 | self.current_dataset.data = data_set |
---|
[7bd6860a] | 168 | self.current_dataset.zaxis("Intensity", unit) |
---|
| 169 | else: |
---|
| 170 | self.current_dataset.y = data_set.flatten() |
---|
| 171 | self.current_dataset.yaxis("Intensity", unit) |
---|
| 172 | continue |
---|
| 173 | elif key == u'Idev': |
---|
[082239e] | 174 | if isinstance(self.current_dataset, plottable_2D): |
---|
[7bd6860a] | 175 | self.current_dataset.err_data = data_set.flatten() |
---|
| 176 | else: |
---|
| 177 | self.current_dataset.dy = data_set.flatten() |
---|
| 178 | continue |
---|
| 179 | elif key == u'Q': |
---|
| 180 | self.current_dataset.xaxis("Q", unit) |
---|
[082239e] | 181 | if isinstance(self.current_dataset, plottable_2D): |
---|
[7bd6860a] | 182 | self.current_dataset.q = data_set.flatten() |
---|
| 183 | else: |
---|
| 184 | self.current_dataset.x = data_set.flatten() |
---|
| 185 | continue |
---|
[bbd0f37] | 186 | elif key == u'Qdev': |
---|
| 187 | self.current_dataset.dx = data_set.flatten() |
---|
| 188 | continue |
---|
[082239e] | 189 | elif key == u'dQw': |
---|
| 190 | self.current_dataset.dxw = data_set.flatten() |
---|
| 191 | continue |
---|
| 192 | elif key == u'dQl': |
---|
| 193 | self.current_dataset.dxl = data_set.flatten() |
---|
| 194 | continue |
---|
[7bd6860a] | 195 | elif key == u'Qy': |
---|
| 196 | self.current_dataset.yaxis("Q_y", unit) |
---|
| 197 | self.current_dataset.qy_data = data_set.flatten() |
---|
| 198 | continue |
---|
| 199 | elif key == u'Qydev': |
---|
| 200 | self.current_dataset.dqy_data = data_set.flatten() |
---|
| 201 | continue |
---|
| 202 | elif key == u'Qx': |
---|
| 203 | self.current_dataset.xaxis("Q_x", unit) |
---|
| 204 | self.current_dataset.qx_data = data_set.flatten() |
---|
| 205 | continue |
---|
| 206 | elif key == u'Qxdev': |
---|
| 207 | self.current_dataset.dqx_data = data_set.flatten() |
---|
| 208 | continue |
---|
| 209 | elif key == u'Mask': |
---|
| 210 | self.current_dataset.mask = data_set.flatten() |
---|
| 211 | continue |
---|
[082239e] | 212 | # Transmission Spectrum |
---|
[c94280c] | 213 | elif (key == u'T' |
---|
| 214 | and self.parent_class == u'SAStransmission_spectrum'): |
---|
[082239e] | 215 | self.trans_spectrum.transmission = data_set.flatten() |
---|
| 216 | continue |
---|
[c94280c] | 217 | elif (key == u'Tdev' |
---|
| 218 | and self.parent_class == u'SAStransmission_spectrum'): |
---|
[082239e] | 219 | self.trans_spectrum.transmission_deviation = \ |
---|
| 220 | data_set.flatten() |
---|
| 221 | continue |
---|
[c94280c] | 222 | elif (key == u'lambda' |
---|
| 223 | and self.parent_class == u'SAStransmission_spectrum'): |
---|
[082239e] | 224 | self.trans_spectrum.wavelength = data_set.flatten() |
---|
| 225 | continue |
---|
[68aa210] | 226 | |
---|
| 227 | for data_point in data_set: |
---|
[5c5e7fd] | 228 | if data_point.dtype.char == 'S': |
---|
| 229 | data_point = decode(bytes(data_point)) |
---|
[082239e] | 230 | # Top Level Meta Data |
---|
[68aa210] | 231 | if key == u'definition': |
---|
[d72567e] | 232 | self.current_datainfo.meta_data['reader'] = data_point |
---|
[68aa210] | 233 | elif key == u'run': |
---|
[d72567e] | 234 | self.current_datainfo.run.append(data_point) |
---|
[be88076] | 235 | try: |
---|
[5c5e7fd] | 236 | run_name = h5attr(value, 'name') |
---|
[be88076] | 237 | run_dict = {data_point: run_name} |
---|
| 238 | self.current_datainfo.run_name = run_dict |
---|
[7b50f14] | 239 | except Exception: |
---|
[be88076] | 240 | pass |
---|
[68aa210] | 241 | elif key == u'title': |
---|
[d72567e] | 242 | self.current_datainfo.title = data_point |
---|
[68aa210] | 243 | elif key == u'SASnote': |
---|
[d72567e] | 244 | self.current_datainfo.notes.append(data_point) |
---|
[68aa210] | 245 | |
---|
[082239e] | 246 | # Sample Information |
---|
| 247 | # CanSAS 2.0 format |
---|
| 248 | elif key == u'Title' and self.parent_class == u'SASsample': |
---|
[d72567e] | 249 | self.current_datainfo.sample.name = data_point |
---|
[082239e] | 250 | # NXcanSAS format |
---|
| 251 | elif key == u'name' and self.parent_class == u'SASsample': |
---|
[88d85c6] | 252 | self.current_datainfo.sample.name = data_point |
---|
[082239e] | 253 | # NXcanSAS format |
---|
| 254 | elif key == u'ID' and self.parent_class == u'SASsample': |
---|
| 255 | self.current_datainfo.sample.name = data_point |
---|
[c94280c] | 256 | elif (key == u'thickness' |
---|
| 257 | and self.parent_class == u'SASsample'): |
---|
[d72567e] | 258 | self.current_datainfo.sample.thickness = data_point |
---|
[c94280c] | 259 | elif (key == u'temperature' |
---|
| 260 | and self.parent_class == u'SASsample'): |
---|
[d72567e] | 261 | self.current_datainfo.sample.temperature = data_point |
---|
[c94280c] | 262 | elif (key == u'transmission' |
---|
| 263 | and self.parent_class == u'SASsample'): |
---|
[5e906207] | 264 | self.current_datainfo.sample.transmission = data_point |
---|
[c94280c] | 265 | elif (key == u'x_position' |
---|
| 266 | and self.parent_class == u'SASsample'): |
---|
[5e906207] | 267 | self.current_datainfo.sample.position.x = data_point |
---|
[c94280c] | 268 | elif (key == u'y_position' |
---|
| 269 | and self.parent_class == u'SASsample'): |
---|
[5e906207] | 270 | self.current_datainfo.sample.position.y = data_point |
---|
[082239e] | 271 | elif key == u'pitch' and self.parent_class == u'SASsample': |
---|
[5e906207] | 272 | self.current_datainfo.sample.orientation.x = data_point |
---|
[082239e] | 273 | elif key == u'yaw' and self.parent_class == u'SASsample': |
---|
| 274 | self.current_datainfo.sample.orientation.y = data_point |
---|
| 275 | elif key == u'roll' and self.parent_class == u'SASsample': |
---|
[5e906207] | 276 | self.current_datainfo.sample.orientation.z = data_point |
---|
[c94280c] | 277 | elif (key == u'details' |
---|
| 278 | and self.parent_class == u'SASsample'): |
---|
[5e906207] | 279 | self.current_datainfo.sample.details.append(data_point) |
---|
[68aa210] | 280 | |
---|
[082239e] | 281 | # Instrumental Information |
---|
[c94280c] | 282 | elif (key == u'name' |
---|
| 283 | and self.parent_class == u'SASinstrument'): |
---|
[d72567e] | 284 | self.current_datainfo.instrument = data_point |
---|
| 285 | elif key == u'name' and self.parent_class == u'SASdetector': |
---|
[ad52d31] | 286 | self.detector.name = data_point |
---|
[d72567e] | 287 | elif key == u'SDD' and self.parent_class == u'SASdetector': |
---|
| 288 | self.detector.distance = float(data_point) |
---|
[d398285] | 289 | self.detector.distance_unit = unit |
---|
[c94280c] | 290 | elif (key == u'slit_length' |
---|
| 291 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 292 | self.detector.slit_length = float(data_point) |
---|
| 293 | self.detector.slit_length_unit = unit |
---|
[c94280c] | 294 | elif (key == u'x_position' |
---|
| 295 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 296 | self.detector.offset.x = float(data_point) |
---|
| 297 | self.detector.offset_unit = unit |
---|
[c94280c] | 298 | elif (key == u'y_position' |
---|
| 299 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 300 | self.detector.offset.y = float(data_point) |
---|
| 301 | self.detector.offset_unit = unit |
---|
[c94280c] | 302 | elif (key == u'pitch' |
---|
| 303 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 304 | self.detector.orientation.x = float(data_point) |
---|
| 305 | self.detector.orientation_unit = unit |
---|
[082239e] | 306 | elif key == u'roll' and self.parent_class == u'SASdetector': |
---|
[5e906207] | 307 | self.detector.orientation.z = float(data_point) |
---|
| 308 | self.detector.orientation_unit = unit |
---|
[082239e] | 309 | elif key == u'yaw' and self.parent_class == u'SASdetector': |
---|
| 310 | self.detector.orientation.y = float(data_point) |
---|
| 311 | self.detector.orientation_unit = unit |
---|
[c94280c] | 312 | elif (key == u'beam_center_x' |
---|
| 313 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 314 | self.detector.beam_center.x = float(data_point) |
---|
| 315 | self.detector.beam_center_unit = unit |
---|
[c94280c] | 316 | elif (key == u'beam_center_y' |
---|
| 317 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 318 | self.detector.beam_center.y = float(data_point) |
---|
| 319 | self.detector.beam_center_unit = unit |
---|
[c94280c] | 320 | elif (key == u'x_pixel_size' |
---|
| 321 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 322 | self.detector.pixel_size.x = float(data_point) |
---|
| 323 | self.detector.pixel_size_unit = unit |
---|
[c94280c] | 324 | elif (key == u'y_pixel_size' |
---|
| 325 | and self.parent_class == u'SASdetector'): |
---|
[5e906207] | 326 | self.detector.pixel_size.y = float(data_point) |
---|
| 327 | self.detector.pixel_size_unit = unit |
---|
[c94280c] | 328 | elif (key == u'distance' |
---|
| 329 | and self.parent_class == u'SAScollimation'): |
---|
[ad52d31] | 330 | self.collimation.length = data_point |
---|
[d398285] | 331 | self.collimation.length_unit = unit |
---|
[c94280c] | 332 | elif (key == u'name' |
---|
| 333 | and self.parent_class == u'SAScollimation'): |
---|
[ad52d31] | 334 | self.collimation.name = data_point |
---|
[c94280c] | 335 | elif (key == u'shape' |
---|
| 336 | and self.parent_class == u'SASaperture'): |
---|
[082239e] | 337 | self.aperture.shape = data_point |
---|
[c94280c] | 338 | elif (key == u'x_gap' |
---|
| 339 | and self.parent_class == u'SASaperture'): |
---|
[082239e] | 340 | self.aperture.size.x = data_point |
---|
[c94280c] | 341 | elif (key == u'y_gap' |
---|
| 342 | and self.parent_class == u'SASaperture'): |
---|
[082239e] | 343 | self.aperture.size.y = data_point |
---|
| 344 | |
---|
| 345 | # Process Information |
---|
[c94280c] | 346 | elif (key == u'Title' |
---|
| 347 | and self.parent_class == u'SASprocess'): # CanSAS 2.0 |
---|
[68aa210] | 348 | self.process.name = data_point |
---|
[c94280c] | 349 | elif (key == u'name' |
---|
| 350 | and self.parent_class == u'SASprocess'): # NXcanSAS |
---|
[68aa210] | 351 | self.process.name = data_point |
---|
[c94280c] | 352 | elif (key == u'description' |
---|
| 353 | and self.parent_class == u'SASprocess'): |
---|
[68aa210] | 354 | self.process.description = data_point |
---|
[d72567e] | 355 | elif key == u'date' and self.parent_class == u'SASprocess': |
---|
[68aa210] | 356 | self.process.date = data_point |
---|
[082239e] | 357 | elif key == u'term' and self.parent_class == u'SASprocess': |
---|
| 358 | self.process.term = data_point |
---|
[d72567e] | 359 | elif self.parent_class == u'SASprocess': |
---|
[ad52d31] | 360 | self.process.notes.append(data_point) |
---|
| 361 | |
---|
[082239e] | 362 | # Source |
---|
[c94280c] | 363 | elif (key == u'wavelength' |
---|
| 364 | and self.parent_class == u'SASdata'): |
---|
[d72567e] | 365 | self.current_datainfo.source.wavelength = data_point |
---|
[5e906207] | 366 | self.current_datainfo.source.wavelength_unit = unit |
---|
[c94280c] | 367 | elif (key == u'incident_wavelength' |
---|
| 368 | and self.parent_class == 'SASsource'): |
---|
[5e906207] | 369 | self.current_datainfo.source.wavelength = data_point |
---|
| 370 | self.current_datainfo.source.wavelength_unit = unit |
---|
[c94280c] | 371 | elif (key == u'wavelength_max' |
---|
| 372 | and self.parent_class == u'SASsource'): |
---|
[5e906207] | 373 | self.current_datainfo.source.wavelength_max = data_point |
---|
| 374 | self.current_datainfo.source.wavelength_max_unit = unit |
---|
[c94280c] | 375 | elif (key == u'wavelength_min' |
---|
| 376 | and self.parent_class == u'SASsource'): |
---|
[5e906207] | 377 | self.current_datainfo.source.wavelength_min = data_point |
---|
| 378 | self.current_datainfo.source.wavelength_min_unit = unit |
---|
[c94280c] | 379 | elif (key == u'incident_wavelength_spread' |
---|
| 380 | and self.parent_class == u'SASsource'): |
---|
[082239e] | 381 | self.current_datainfo.source.wavelength_spread = \ |
---|
| 382 | data_point |
---|
| 383 | self.current_datainfo.source.wavelength_spread_unit = \ |
---|
| 384 | unit |
---|
[c94280c] | 385 | elif (key == u'beam_size_x' |
---|
| 386 | and self.parent_class == u'SASsource'): |
---|
[5e906207] | 387 | self.current_datainfo.source.beam_size.x = data_point |
---|
| 388 | self.current_datainfo.source.beam_size_unit = unit |
---|
[c94280c] | 389 | elif (key == u'beam_size_y' |
---|
| 390 | and self.parent_class == u'SASsource'): |
---|
[5e906207] | 391 | self.current_datainfo.source.beam_size.y = data_point |
---|
| 392 | self.current_datainfo.source.beam_size_unit = unit |
---|
[c94280c] | 393 | elif (key == u'beam_shape' |
---|
| 394 | and self.parent_class == u'SASsource'): |
---|
[5e906207] | 395 | self.current_datainfo.source.beam_shape = data_point |
---|
[c94280c] | 396 | elif (key == u'radiation' |
---|
| 397 | and self.parent_class == u'SASsource'): |
---|
[d72567e] | 398 | self.current_datainfo.source.radiation = data_point |
---|
[c94280c] | 399 | elif (key == u'transmission' |
---|
| 400 | and self.parent_class == u'SASdata'): |
---|
[d72567e] | 401 | self.current_datainfo.sample.transmission = data_point |
---|
[68aa210] | 402 | |
---|
[082239e] | 403 | # Everything else goes in meta_data |
---|
[68aa210] | 404 | else: |
---|
[082239e] | 405 | new_key = self._create_unique_key( |
---|
| 406 | self.current_datainfo.meta_data, key) |
---|
[d72567e] | 407 | self.current_datainfo.meta_data[new_key] = data_point |
---|
[68aa210] | 408 | |
---|
| 409 | else: |
---|
[082239e] | 410 | # I don't know if this reachable code |
---|
[68aa210] | 411 | self.errors.add("ShouldNeverHappenException") |
---|
| 412 | |
---|
[d72567e] | 413 | def add_intermediate(self): |
---|
[ad52d31] | 414 | """ |
---|
[082239e] | 415 | This method stores any intermediate objects within the final data set |
---|
| 416 | after fully reading the set. |
---|
[ad52d31] | 417 | |
---|
[082239e] | 418 | :param parent: The NXclass name for the h5py Group object that just |
---|
| 419 | finished being processed |
---|
[ad52d31] | 420 | """ |
---|
| 421 | |
---|
[d72567e] | 422 | if self.parent_class == u'SASprocess': |
---|
| 423 | self.current_datainfo.process.append(self.process) |
---|
[ad52d31] | 424 | self.process = Process() |
---|
[d72567e] | 425 | elif self.parent_class == u'SASdetector': |
---|
| 426 | self.current_datainfo.detector.append(self.detector) |
---|
[ad52d31] | 427 | self.detector = Detector() |
---|
[d72567e] | 428 | elif self.parent_class == u'SAStransmission_spectrum': |
---|
| 429 | self.current_datainfo.trans_spectrum.append(self.trans_spectrum) |
---|
[ad52d31] | 430 | self.trans_spectrum = TransmissionSpectrum() |
---|
[d72567e] | 431 | elif self.parent_class == u'SAScollimation': |
---|
| 432 | self.current_datainfo.collimation.append(self.collimation) |
---|
[ad52d31] | 433 | self.collimation = Collimation() |
---|
[d72567e] | 434 | elif self.parent_class == u'SASaperture': |
---|
[ad52d31] | 435 | self.collimation.aperture.append(self.aperture) |
---|
| 436 | self.aperture = Aperture() |
---|
[d72567e] | 437 | elif self.parent_class == u'SASdata': |
---|
[082239e] | 438 | if isinstance(self.current_dataset, plottable_2D): |
---|
[d72567e] | 439 | self.data2d.append(self.current_dataset) |
---|
[082239e] | 440 | elif isinstance(self.current_dataset, plottable_1D): |
---|
[d72567e] | 441 | self.data1d.append(self.current_dataset) |
---|
[68aa210] | 442 | |
---|
| 443 | def final_data_cleanup(self): |
---|
| 444 | """ |
---|
[082239e] | 445 | Does some final cleanup and formatting on self.current_datainfo and |
---|
| 446 | all data1D and data2D objects and then combines the data and info into |
---|
| 447 | Data1D and Data2D objects |
---|
[68aa210] | 448 | """ |
---|
[082239e] | 449 | # Type cast data arrays to float64 |
---|
[d72567e] | 450 | if len(self.current_datainfo.trans_spectrum) > 0: |
---|
[ad52d31] | 451 | spectrum_list = [] |
---|
[d72567e] | 452 | for spectrum in self.current_datainfo.trans_spectrum: |
---|
[ad52d31] | 453 | spectrum.transmission = np.delete(spectrum.transmission, [0]) |
---|
| 454 | spectrum.transmission = spectrum.transmission.astype(np.float64) |
---|
[082239e] | 455 | spectrum.transmission_deviation = np.delete( |
---|
| 456 | spectrum.transmission_deviation, [0]) |
---|
| 457 | spectrum.transmission_deviation = \ |
---|
| 458 | spectrum.transmission_deviation.astype(np.float64) |
---|
[ad52d31] | 459 | spectrum.wavelength = np.delete(spectrum.wavelength, [0]) |
---|
| 460 | spectrum.wavelength = spectrum.wavelength.astype(np.float64) |
---|
[d72567e] | 461 | if len(spectrum.transmission) > 0: |
---|
| 462 | spectrum_list.append(spectrum) |
---|
| 463 | self.current_datainfo.trans_spectrum = spectrum_list |
---|
[68aa210] | 464 | |
---|
[082239e] | 465 | # Append errors to dataset and reset class errors |
---|
[d72567e] | 466 | self.current_datainfo.errors = self.errors |
---|
[68aa210] | 467 | self.errors.clear() |
---|
| 468 | |
---|
[082239e] | 469 | # Combine all plottables with datainfo and append each to output |
---|
| 470 | # Type cast data arrays to float64 and find min/max as appropriate |
---|
[d72567e] | 471 | for dataset in self.data2d: |
---|
| 472 | zeros = np.ones(dataset.data.size, dtype=bool) |
---|
| 473 | try: |
---|
[082239e] | 474 | for i in range(0, dataset.mask.size - 1): |
---|
[d72567e] | 475 | zeros[i] = dataset.mask[i] |
---|
| 476 | except: |
---|
| 477 | self.errors.add(sys.exc_value) |
---|
| 478 | dataset.mask = zeros |
---|
[082239e] | 479 | # Calculate the actual Q matrix |
---|
[d72567e] | 480 | try: |
---|
| 481 | if dataset.q_data.size <= 1: |
---|
[54544637] | 482 | dataset.q_data = np.sqrt(dataset.qx_data |
---|
| 483 | * dataset.qx_data |
---|
| 484 | + dataset.qy_data |
---|
| 485 | * dataset.qy_data) |
---|
[d72567e] | 486 | except: |
---|
| 487 | dataset.q_data = None |
---|
[ac370c5] | 488 | |
---|
| 489 | if dataset.data.ndim == 2: |
---|
| 490 | (n_rows, n_cols) = dataset.data.shape |
---|
[479799c] | 491 | dataset.y_bins = dataset.qy_data[0::n_cols] |
---|
[ac370c5] | 492 | dataset.x_bins = dataset.qx_data[:n_cols] |
---|
| 493 | dataset.data = dataset.data.flatten() |
---|
[9d786e5] | 494 | self.current_dataset = dataset |
---|
| 495 | self.send_to_output() |
---|
[d72567e] | 496 | |
---|
| 497 | for dataset in self.data1d: |
---|
[9d786e5] | 498 | self.current_dataset = dataset |
---|
| 499 | self.send_to_output() |
---|
[d72567e] | 500 | |
---|
[68aa210] | 501 | def add_data_set(self, key=""): |
---|
| 502 | """ |
---|
[082239e] | 503 | Adds the current_dataset to the list of outputs after preforming final |
---|
| 504 | processing on the data and then calls a private method to generate a |
---|
| 505 | new data set. |
---|
[68aa210] | 506 | |
---|
| 507 | :param key: NeXus group name for current tree level |
---|
| 508 | """ |
---|
[d72567e] | 509 | |
---|
| 510 | if self.current_datainfo and self.current_dataset: |
---|
[68aa210] | 511 | self.final_data_cleanup() |
---|
[d72567e] | 512 | self.data1d = [] |
---|
| 513 | self.data2d = [] |
---|
| 514 | self.current_datainfo = DataInfo() |
---|
[68aa210] | 515 | |
---|
[54ba66e] | 516 | |
---|
[082239e] | 517 | def _initialize_new_data_set(self, parent_list=None): |
---|
[68aa210] | 518 | """ |
---|
[082239e] | 519 | A private class method to generate a new 1D or 2D data object based on |
---|
| 520 | the type of data within the set. Outside methods should call |
---|
| 521 | add_data_set() to be sure any existing data is stored properly. |
---|
[68aa210] | 522 | |
---|
[d72567e] | 523 | :param parent_list: List of names of parent elements |
---|
[68aa210] | 524 | """ |
---|
[d72567e] | 525 | |
---|
| 526 | if parent_list is None: |
---|
| 527 | parent_list = [] |
---|
| 528 | if self._find_intermediate(parent_list, "Qx"): |
---|
| 529 | self.current_dataset = plottable_2D() |
---|
[68aa210] | 530 | else: |
---|
| 531 | x = np.array(0) |
---|
| 532 | y = np.array(0) |
---|
[d72567e] | 533 | self.current_dataset = plottable_1D(x, y) |
---|
| 534 | self.current_datainfo.filename = self.raw_data.filename |
---|
[68aa210] | 535 | |
---|
[d72567e] | 536 | def _find_intermediate(self, parent_list, basename=""): |
---|
[ad52d31] | 537 | """ |
---|
[082239e] | 538 | A private class used to find an entry by either using a direct key or |
---|
| 539 | knowing the approximate basename. |
---|
[ad52d31] | 540 | |
---|
[082239e] | 541 | :param parent_list: List of parents nodes in the HDF5 file |
---|
[d72567e] | 542 | :param basename: Approximate name of an entry to search for |
---|
[ad52d31] | 543 | :return: |
---|
| 544 | """ |
---|
[d72567e] | 545 | |
---|
| 546 | entry = False |
---|
| 547 | key_prog = re.compile(basename) |
---|
| 548 | top = self.raw_data |
---|
| 549 | for parent in parent_list: |
---|
| 550 | top = top.get(parent) |
---|
| 551 | for key in top.keys(): |
---|
[082239e] | 552 | if key_prog.match(key): |
---|
[d72567e] | 553 | entry = True |
---|
| 554 | break |
---|
[ad52d31] | 555 | return entry |
---|
| 556 | |
---|
[68aa210] | 557 | def _create_unique_key(self, dictionary, name, numb=0): |
---|
| 558 | """ |
---|
| 559 | Create a unique key value for any dictionary to prevent overwriting |
---|
| 560 | Recurses until a unique key value is found. |
---|
| 561 | |
---|
| 562 | :param dictionary: A dictionary with any number of entries |
---|
| 563 | :param name: The index of the item to be added to dictionary |
---|
| 564 | :param numb: The number to be appended to the name, starts at 0 |
---|
[d72567e] | 565 | :return: The new name for the dictionary entry |
---|
[68aa210] | 566 | """ |
---|
| 567 | if dictionary.get(name) is not None: |
---|
| 568 | numb += 1 |
---|
| 569 | name = name.split("_")[0] |
---|
| 570 | name += "_{0}".format(numb) |
---|
| 571 | name = self._create_unique_key(dictionary, name, numb) |
---|
[d398285] | 572 | return name |
---|
| 573 | |
---|
| 574 | def _get_unit(self, value): |
---|
| 575 | """ |
---|
| 576 | Find the unit for a particular value within the h5py dictionary |
---|
| 577 | |
---|
| 578 | :param value: attribute dictionary for a particular value set |
---|
[d72567e] | 579 | :return: unit for the value passed to the method |
---|
[d398285] | 580 | """ |
---|
[5c5e7fd] | 581 | unit = h5attr(value, u'units') |
---|
[54544637] | 582 | if unit is None: |
---|
[5c5e7fd] | 583 | unit = h5attr(value, u'unit') |
---|
[082239e] | 584 | # Convert the unit formats |
---|
[d398285] | 585 | if unit == "1/A": |
---|
| 586 | unit = "A^{-1}" |
---|
| 587 | elif unit == "1/cm": |
---|
| 588 | unit = "cm^{-1}" |
---|
[54ba66e] | 589 | return unit |
---|