[68aa210] | 1 | """ |
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[802fc18] | 2 | NXcanSAS data reader for reading HDF5 formatted CanSAS files. |
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[68aa210] | 3 | """ |
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| 4 | |
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| 5 | import h5py |
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| 6 | import numpy as np |
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| 7 | import re |
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| 8 | import os |
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| 9 | import sys |
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| 10 | |
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[7b50f14] | 11 | from ..data_info import plottable_1D, plottable_2D,\ |
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[082239e] | 12 | Data1D, Data2D, DataInfo, Process, Aperture, Collimation, \ |
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| 13 | TransmissionSpectrum, Detector |
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[7b50f14] | 14 | from ..loader_exceptions import FileContentsException, DefaultReaderException |
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| 15 | from ..file_reader_base_class import FileReader, decode |
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[d72567e] | 16 | |
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[9220e89c] | 17 | try: |
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| 18 | basestring |
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| 19 | except NameError: # CRUFT: python 2 support |
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| 20 | basestring = str |
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| 21 | |
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[4fdcc65] | 22 | |
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[5c5e7fd] | 23 | def h5attr(node, key, default=None): |
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| 24 | return decode(node.attrs.get(key, default)) |
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[68aa210] | 25 | |
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[4fdcc65] | 26 | |
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[9d786e5] | 27 | class Reader(FileReader): |
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[68aa210] | 28 | """ |
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[802fc18] | 29 | A class for reading in NXcanSAS data files. The current implementation has |
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| 30 | been tested to load data generated by multiple facilities, all of which are |
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| 31 | known to produce NXcanSAS standards compliant data. Any number of data sets |
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| 32 | may be present within the file and any dimensionality of data may be used. |
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| 33 | Currently 1D and 2D SAS data sets are supported, but should be immediately |
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| 34 | extensible to SESANS data. |
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[d72567e] | 35 | |
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[802fc18] | 36 | Any number of SASdata groups may be present in a SASentry and the data |
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| 37 | within each SASdata group can be a single 1D I(Q), multi-framed 1D I(Q), |
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| 38 | 2D I(Qx, Qy) or multi-framed 2D I(Qx, Qy). |
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[5e906207] | 39 | |
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[68aa210] | 40 | :Dependencies: |
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[802fc18] | 41 | The NXcanSAS HDF5 reader requires h5py => v2.5.0 or later. |
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[68aa210] | 42 | """ |
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| 43 | |
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[082239e] | 44 | # CanSAS version |
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[68aa210] | 45 | cansas_version = 2.0 |
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[082239e] | 46 | # Data type name |
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[cf820f5] | 47 | type_name = "NXcanSAS" |
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[082239e] | 48 | # Wildcards |
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[cf820f5] | 49 | type = ["NXcanSAS HDF5 Files (*.h5)|*.h5|"] |
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[082239e] | 50 | # List of allowed extensions |
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[68aa210] | 51 | ext = ['.h5', '.H5'] |
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[082239e] | 52 | # Flag to bypass extension check |
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[54544637] | 53 | allow_all = True |
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[68aa210] | 54 | |
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[9d786e5] | 55 | def get_file_contents(self): |
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[68aa210] | 56 | """ |
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[ad52d31] | 57 | This is the general read method that all SasView data_loaders must have. |
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[68aa210] | 58 | |
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| 59 | :param filename: A path for an HDF5 formatted CanSAS 2D data file. |
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[d72567e] | 60 | :return: List of Data1D/2D objects and/or a list of errors. |
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[68aa210] | 61 | """ |
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[082239e] | 62 | # Reinitialize when loading a new data file to reset all class variables |
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[61f329f0] | 63 | self.reset_state() |
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[9d786e5] | 64 | |
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| 65 | filename = self.f_open.name |
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| 66 | self.f_open.close() # IO handled by h5py |
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| 67 | |
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[082239e] | 68 | # Check that the file exists |
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[68aa210] | 69 | if os.path.isfile(filename): |
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| 70 | basename = os.path.basename(filename) |
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| 71 | _, extension = os.path.splitext(basename) |
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| 72 | # If the file type is not allowed, return empty list |
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| 73 | if extension in self.ext or self.allow_all: |
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[082239e] | 74 | # Load the data file |
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[7f75a3f] | 75 | try: |
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| 76 | self.raw_data = h5py.File(filename, 'r') |
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| 77 | except Exception as e: |
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[8dec7e7] | 78 | if extension not in self.ext: |
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[4fdcc65] | 79 | msg = "NXcanSAS Reader could not load file {}".format( |
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| 80 | basename + extension) |
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[8dec7e7] | 81 | raise DefaultReaderException(msg) |
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| 82 | raise FileContentsException(e.message) |
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[dcb91cf] | 83 | try: |
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| 84 | # Read in all child elements of top level SASroot |
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| 85 | self.read_children(self.raw_data, []) |
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| 86 | # Add the last data set to the list of outputs |
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| 87 | self.add_data_set() |
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| 88 | except Exception as exc: |
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| 89 | raise FileContentsException(exc.message) |
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| 90 | finally: |
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| 91 | # Close the data file |
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| 92 | self.raw_data.close() |
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| 93 | |
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[4fdcc65] | 94 | for data_set in self.output: |
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| 95 | if isinstance(data_set, Data1D): |
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| 96 | if data_set.x.size < 5: |
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| 97 | exception = FileContentsException( |
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| 98 | "Fewer than 5 data points found.") |
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| 99 | data_set.errors.append(exception) |
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[68aa210] | 100 | |
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[61f329f0] | 101 | def reset_state(self): |
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[d72567e] | 102 | """ |
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| 103 | Create the reader object and define initial states for class variables |
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| 104 | """ |
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[61f329f0] | 105 | super(Reader, self).reset_state() |
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[d72567e] | 106 | self.data1d = [] |
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| 107 | self.data2d = [] |
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| 108 | self.raw_data = None |
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[802fc18] | 109 | self.multi_frame = False |
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| 110 | self.data_frames = [] |
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| 111 | self.data_uncertainty_frames = [] |
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[282bc3f] | 112 | self.errors = [] |
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[d72567e] | 113 | self.logging = [] |
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[b204004] | 114 | self.q_names = [] |
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[2651724] | 115 | self.mask_name = u'' |
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| 116 | self.i_name = u'' |
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| 117 | self.i_node = u'' |
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[b204004] | 118 | self.i_uncertainties_name = u'' |
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| 119 | self.q_uncertainty_names = [] |
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| 120 | self.q_resolution_names = [] |
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[d72567e] | 121 | self.parent_class = u'' |
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| 122 | self.detector = Detector() |
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| 123 | self.collimation = Collimation() |
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| 124 | self.aperture = Aperture() |
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| 125 | self.process = Process() |
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| 126 | self.trans_spectrum = TransmissionSpectrum() |
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| 127 | |
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| 128 | def read_children(self, data, parent_list): |
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[68aa210] | 129 | """ |
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[ad52d31] | 130 | A recursive method for stepping through the hierarchical data file. |
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[68aa210] | 131 | |
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| 132 | :param data: h5py Group object of any kind |
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| 133 | :param parent: h5py Group parent name |
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| 134 | """ |
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| 135 | |
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[082239e] | 136 | # Loop through each element of the parent and process accordingly |
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[68aa210] | 137 | for key in data.keys(): |
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[082239e] | 138 | # Get all information for the current key |
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[68aa210] | 139 | value = data.get(key) |
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[7b50f14] | 140 | class_name = h5attr(value, u'canSAS_class') |
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[2ca5d57b] | 141 | if isinstance(class_name, (list, tuple, np.ndarray)): |
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| 142 | class_name = class_name[0] |
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[7b50f14] | 143 | if class_name is None: |
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[5c5e7fd] | 144 | class_name = h5attr(value, u'NX_class') |
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[68aa210] | 145 | if class_name is not None: |
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| 146 | class_prog = re.compile(class_name) |
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| 147 | else: |
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| 148 | class_prog = re.compile(value.name) |
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| 149 | |
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| 150 | if isinstance(value, h5py.Group): |
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[c9ecd1b] | 151 | # Set parent class before recursion |
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[8f882fe] | 152 | last_parent_class = self.parent_class |
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[d72567e] | 153 | self.parent_class = class_name |
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| 154 | parent_list.append(key) |
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[082239e] | 155 | # If a new sasentry, store the current data sets and create |
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| 156 | # a fresh Data1D/2D object |
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[68aa210] | 157 | if class_prog.match(u'SASentry'): |
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| 158 | self.add_data_set(key) |
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[d72567e] | 159 | elif class_prog.match(u'SASdata'): |
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[9e0dd49] | 160 | self._find_data_attributes(value) |
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[802fc18] | 161 | self._initialize_new_data_set(value) |
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[082239e] | 162 | # Recursion step to access data within the group |
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[d72567e] | 163 | self.read_children(value, parent_list) |
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| 164 | self.add_intermediate() |
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[8f882fe] | 165 | # Reset parent class when returning from recursive method |
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| 166 | self.parent_class = last_parent_class |
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[d72567e] | 167 | parent_list.remove(key) |
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[68aa210] | 168 | |
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| 169 | elif isinstance(value, h5py.Dataset): |
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[082239e] | 170 | # If this is a dataset, store the data appropriately |
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[9dc1500] | 171 | data_set = value.value |
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[7bd6860a] | 172 | unit = self._get_unit(value) |
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[ac370c5] | 173 | |
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[68aa210] | 174 | for data_point in data_set: |
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[2b538cd] | 175 | if isinstance(data_point, np.ndarray): |
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| 176 | if data_point.dtype.char == 'S': |
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| 177 | data_point = decode(bytes(data_point)) |
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| 178 | else: |
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| 179 | data_point = decode(data_point) |
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[082239e] | 180 | # Top Level Meta Data |
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[68aa210] | 181 | if key == u'definition': |
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[c1dc994] | 182 | if isinstance(data_set, basestring): |
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| 183 | self.current_datainfo.meta_data['reader'] = data_set |
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| 184 | break |
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| 185 | else: |
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| 186 | self.current_datainfo.meta_data[ |
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| 187 | 'reader'] = data_point |
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[0d93464] | 188 | # Run |
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[68aa210] | 189 | elif key == u'run': |
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[be88076] | 190 | try: |
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[5c5e7fd] | 191 | run_name = h5attr(value, 'name') |
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[dfcdbf8] | 192 | run_dict = {data_set: run_name} |
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[be88076] | 193 | self.current_datainfo.run_name = run_dict |
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[7b50f14] | 194 | except Exception: |
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[be88076] | 195 | pass |
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[c1dc994] | 196 | if isinstance(data_set, basestring): |
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| 197 | self.current_datainfo.run.append(data_set) |
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| 198 | break |
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| 199 | else: |
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| 200 | self.current_datainfo.run.append(data_point) |
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[0d93464] | 201 | # Title |
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[68aa210] | 202 | elif key == u'title': |
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[c1dc994] | 203 | if isinstance(data_set, basestring): |
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| 204 | self.current_datainfo.title = data_set |
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| 205 | break |
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| 206 | else: |
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| 207 | self.current_datainfo.title = data_point |
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[0d93464] | 208 | # Note |
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[68aa210] | 209 | elif key == u'SASnote': |
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[dfcdbf8] | 210 | self.current_datainfo.notes.append(data_set) |
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| 211 | break |
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[082239e] | 212 | # Sample Information |
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[0d93464] | 213 | elif self.parent_class == u'SASsample': |
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| 214 | self.process_sample(data_point, key) |
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[082239e] | 215 | # Instrumental Information |
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[c94280c] | 216 | elif (key == u'name' |
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| 217 | and self.parent_class == u'SASinstrument'): |
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[d72567e] | 218 | self.current_datainfo.instrument = data_point |
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[0d93464] | 219 | # Detector |
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| 220 | elif self.parent_class == u'SASdetector': |
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| 221 | self.process_detector(data_point, key, unit) |
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| 222 | # Collimation |
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| 223 | elif self.parent_class == u'SAScollimation': |
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| 224 | self.process_collimation(data_point, key, unit) |
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| 225 | # Aperture |
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| 226 | elif self.parent_class == u'SASaperture': |
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| 227 | self.process_aperture(data_point, key) |
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[082239e] | 228 | # Process Information |
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[0d93464] | 229 | elif self.parent_class == u'SASprocess': # CanSAS 2.0 |
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| 230 | self.process_process(data_point, key) |
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[082239e] | 231 | # Source |
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[0d93464] | 232 | elif self.parent_class == u'SASsource': |
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| 233 | self.process_source(data_point, key, unit) |
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[082239e] | 234 | # Everything else goes in meta_data |
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[0d93464] | 235 | elif self.parent_class == u'SASdata': |
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[96d06a4] | 236 | if isinstance(self.current_dataset, plottable_2D): |
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| 237 | self.process_2d_data_object(data_set, key, unit) |
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| 238 | else: |
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| 239 | self.process_1d_data_object(data_set, key, unit) |
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| 240 | |
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[0d93464] | 241 | break |
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| 242 | elif self.parent_class == u'SAStransmission_spectrum': |
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| 243 | self.process_trans_spectrum(data_set, key) |
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| 244 | break |
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[68aa210] | 245 | else: |
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[082239e] | 246 | new_key = self._create_unique_key( |
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| 247 | self.current_datainfo.meta_data, key) |
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[d72567e] | 248 | self.current_datainfo.meta_data[new_key] = data_point |
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[68aa210] | 249 | |
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| 250 | else: |
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[082239e] | 251 | # I don't know if this reachable code |
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[282bc3f] | 252 | self.errors.append("ShouldNeverHappenException") |
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[68aa210] | 253 | |
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[96d06a4] | 254 | def process_1d_data_object(self, data_set, key, unit): |
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[0d93464] | 255 | """ |
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[96d06a4] | 256 | SASdata processor method for 1d data items |
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[0d93464] | 257 | :param data_set: data from HDF5 file |
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| 258 | :param key: canSAS_class attribute |
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| 259 | :param unit: unit attribute |
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| 260 | """ |
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[2651724] | 261 | if key == self.i_name: |
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[802fc18] | 262 | if self.multi_frame: |
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| 263 | for x in range(0, data_set.shape[0]): |
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| 264 | self.data_frames.append(data_set[x].flatten()) |
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| 265 | else: |
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| 266 | self.current_dataset.y = data_set.flatten() |
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| 267 | self.current_dataset.yaxis("Intensity", unit) |
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[b204004] | 268 | elif key == self.i_uncertainties_name: |
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[802fc18] | 269 | if self.multi_frame: |
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| 270 | for x in range(0, data_set.shape[0]): |
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| 271 | self.data_uncertainty_frames.append(data_set[x].flatten()) |
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[96d06a4] | 272 | self.current_dataset.dy = data_set.flatten() |
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[b204004] | 273 | elif key in self.q_names: |
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[0d93464] | 274 | self.current_dataset.xaxis("Q", unit) |
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[96d06a4] | 275 | self.current_dataset.x = data_set.flatten() |
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[b204004] | 276 | elif key in self.q_resolution_names: |
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| 277 | if (len(self.q_resolution_names) > 1 |
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| 278 | and np.where(self.q_resolution_names == key)[0] == 0): |
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[2651724] | 279 | self.current_dataset.dxw = data_set.flatten() |
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[b204004] | 280 | elif (len(self.q_resolution_names) > 1 |
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| 281 | and np.where(self.q_resolution_names == key)[0] == 1): |
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| 282 | self.current_dataset.dxl = data_set.flatten() |
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| 283 | else: |
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| 284 | self.current_dataset.dx = data_set.flatten() |
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| 285 | elif key in self.q_uncertainty_names: |
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| 286 | if (len(self.q_uncertainty_names) > 1 |
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| 287 | and np.where(self.q_uncertainty_names == key)[0] == 0): |
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| 288 | self.current_dataset.dxw = data_set.flatten() |
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| 289 | elif (len(self.q_uncertainty_names) > 1 |
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| 290 | and np.where(self.q_uncertainty_names == key)[0] == 1): |
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[2651724] | 291 | self.current_dataset.dxl = data_set.flatten() |
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| 292 | else: |
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| 293 | self.current_dataset.dx = data_set.flatten() |
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[96d06a4] | 294 | elif key == self.mask_name: |
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| 295 | self.current_dataset.mask = data_set.flatten() |
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| 296 | elif key == u'wavelength': |
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| 297 | self.current_datainfo.source.wavelength = data_set[0] |
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| 298 | self.current_datainfo.source.wavelength_unit = unit |
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| 299 | |
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| 300 | def process_2d_data_object(self, data_set, key, unit): |
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| 301 | if key == self.i_name: |
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[4fdcc65] | 302 | self.current_dataset.data = data_set |
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[96d06a4] | 303 | self.current_dataset.zaxis("Intensity", unit) |
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[b204004] | 304 | elif key == self.i_uncertainties_name: |
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[96d06a4] | 305 | self.current_dataset.err_data = data_set.flatten() |
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[b204004] | 306 | elif key in self.q_names: |
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[c2525bf] | 307 | self.current_dataset.xaxis("Q_x", unit) |
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| 308 | self.current_dataset.yaxis("Q_y", unit) |
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[b204004] | 309 | if self.q_names[0] == self.q_names[1]: |
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[c2525bf] | 310 | # All q data in a single array |
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[4fdcc65] | 311 | self.current_dataset.qx_data = data_set[0] |
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| 312 | self.current_dataset.qy_data = data_set[1] |
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[b204004] | 313 | elif self.q_names.index(key) == 0: |
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[4fdcc65] | 314 | self.current_dataset.qx_data = data_set |
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[b204004] | 315 | elif self.q_names.index(key) == 1: |
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[4fdcc65] | 316 | self.current_dataset.qy_data = data_set |
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[b204004] | 317 | elif key in self.q_uncertainty_names or key in self.q_resolution_names: |
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| 318 | if ((self.q_uncertainty_names[0] == self.q_uncertainty_names[1]) or |
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| 319 | (self.q_resolution_names[0] == self.q_resolution_names[1])): |
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[c2525bf] | 320 | # All q data in a single array |
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| 321 | self.current_dataset.dqx_data = data_set[0].flatten() |
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| 322 | self.current_dataset.dqy_data = data_set[1].flatten() |
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[b204004] | 323 | elif (self.q_uncertainty_names.index(key) == 0 or |
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| 324 | self.q_resolution_names.index(key) == 0): |
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[c2525bf] | 325 | self.current_dataset.dqx_data = data_set.flatten() |
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[b204004] | 326 | elif (self.q_uncertainty_names.index(key) == 1 or |
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| 327 | self.q_resolution_names.index(key) == 1): |
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[c2525bf] | 328 | self.current_dataset.dqy_data = data_set.flatten() |
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| 329 | self.current_dataset.yaxis("Q_y", unit) |
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| 330 | elif key == self.mask_name: |
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| 331 | self.current_dataset.mask = data_set.flatten() |
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[0d93464] | 332 | elif key == u'Qy': |
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| 333 | self.current_dataset.yaxis("Q_y", unit) |
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| 334 | self.current_dataset.qy_data = data_set.flatten() |
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| 335 | elif key == u'Qydev': |
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| 336 | self.current_dataset.dqy_data = data_set.flatten() |
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| 337 | elif key == u'Qx': |
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| 338 | self.current_dataset.xaxis("Q_x", unit) |
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| 339 | self.current_dataset.qx_data = data_set.flatten() |
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| 340 | elif key == u'Qxdev': |
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| 341 | self.current_dataset.dqx_data = data_set.flatten() |
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| 342 | |
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| 343 | def process_trans_spectrum(self, data_set, key): |
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| 344 | """ |
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| 345 | SAStransmission_spectrum processor |
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| 346 | :param data_set: data from HDF5 file |
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| 347 | :param key: canSAS_class attribute |
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| 348 | """ |
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| 349 | if key == u'T': |
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| 350 | self.trans_spectrum.transmission = data_set.flatten() |
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| 351 | elif key == u'Tdev': |
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| 352 | self.trans_spectrum.transmission_deviation = data_set.flatten() |
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| 353 | elif key == u'lambda': |
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| 354 | self.trans_spectrum.wavelength = data_set.flatten() |
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| 355 | |
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| 356 | def process_sample(self, data_point, key): |
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| 357 | """ |
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| 358 | SASsample processor |
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| 359 | :param data_point: Single point from an HDF5 data file |
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| 360 | :param key: class name data_point was taken from |
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| 361 | """ |
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| 362 | if key == u'Title': |
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| 363 | self.current_datainfo.sample.name = data_point |
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| 364 | elif key == u'name': |
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| 365 | self.current_datainfo.sample.name = data_point |
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| 366 | elif key == u'ID': |
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| 367 | self.current_datainfo.sample.name = data_point |
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| 368 | elif key == u'thickness': |
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| 369 | self.current_datainfo.sample.thickness = data_point |
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| 370 | elif key == u'temperature': |
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| 371 | self.current_datainfo.sample.temperature = data_point |
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| 372 | elif key == u'transmission': |
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| 373 | self.current_datainfo.sample.transmission = data_point |
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| 374 | elif key == u'x_position': |
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| 375 | self.current_datainfo.sample.position.x = data_point |
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| 376 | elif key == u'y_position': |
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| 377 | self.current_datainfo.sample.position.y = data_point |
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| 378 | elif key == u'pitch': |
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| 379 | self.current_datainfo.sample.orientation.x = data_point |
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| 380 | elif key == u'yaw': |
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| 381 | self.current_datainfo.sample.orientation.y = data_point |
---|
| 382 | elif key == u'roll': |
---|
| 383 | self.current_datainfo.sample.orientation.z = data_point |
---|
| 384 | elif key == u'details': |
---|
| 385 | self.current_datainfo.sample.details.append(data_point) |
---|
| 386 | |
---|
| 387 | def process_detector(self, data_point, key, unit): |
---|
| 388 | """ |
---|
| 389 | SASdetector processor |
---|
| 390 | :param data_point: Single point from an HDF5 data file |
---|
| 391 | :param key: class name data_point was taken from |
---|
| 392 | :param unit: unit attribute from data set |
---|
| 393 | """ |
---|
| 394 | if key == u'name': |
---|
| 395 | self.detector.name = data_point |
---|
| 396 | elif key == u'SDD': |
---|
| 397 | self.detector.distance = float(data_point) |
---|
| 398 | self.detector.distance_unit = unit |
---|
| 399 | elif key == u'slit_length': |
---|
| 400 | self.detector.slit_length = float(data_point) |
---|
| 401 | self.detector.slit_length_unit = unit |
---|
| 402 | elif key == u'x_position': |
---|
| 403 | self.detector.offset.x = float(data_point) |
---|
| 404 | self.detector.offset_unit = unit |
---|
| 405 | elif key == u'y_position': |
---|
| 406 | self.detector.offset.y = float(data_point) |
---|
| 407 | self.detector.offset_unit = unit |
---|
| 408 | elif key == u'pitch': |
---|
| 409 | self.detector.orientation.x = float(data_point) |
---|
| 410 | self.detector.orientation_unit = unit |
---|
| 411 | elif key == u'roll': |
---|
| 412 | self.detector.orientation.z = float(data_point) |
---|
| 413 | self.detector.orientation_unit = unit |
---|
| 414 | elif key == u'yaw': |
---|
| 415 | self.detector.orientation.y = float(data_point) |
---|
| 416 | self.detector.orientation_unit = unit |
---|
| 417 | elif key == u'beam_center_x': |
---|
| 418 | self.detector.beam_center.x = float(data_point) |
---|
| 419 | self.detector.beam_center_unit = unit |
---|
| 420 | elif key == u'beam_center_y': |
---|
| 421 | self.detector.beam_center.y = float(data_point) |
---|
| 422 | self.detector.beam_center_unit = unit |
---|
| 423 | elif key == u'x_pixel_size': |
---|
| 424 | self.detector.pixel_size.x = float(data_point) |
---|
| 425 | self.detector.pixel_size_unit = unit |
---|
| 426 | elif key == u'y_pixel_size': |
---|
| 427 | self.detector.pixel_size.y = float(data_point) |
---|
| 428 | self.detector.pixel_size_unit = unit |
---|
| 429 | |
---|
| 430 | def process_collimation(self, data_point, key, unit): |
---|
| 431 | """ |
---|
| 432 | SAScollimation processor |
---|
| 433 | :param data_point: Single point from an HDF5 data file |
---|
| 434 | :param key: class name data_point was taken from |
---|
| 435 | :param unit: unit attribute from data set |
---|
| 436 | """ |
---|
| 437 | if key == u'distance': |
---|
| 438 | self.collimation.length = data_point |
---|
| 439 | self.collimation.length_unit = unit |
---|
| 440 | elif key == u'name': |
---|
| 441 | self.collimation.name = data_point |
---|
| 442 | |
---|
| 443 | def process_aperture(self, data_point, key): |
---|
| 444 | """ |
---|
| 445 | SASaperture processor |
---|
| 446 | :param data_point: Single point from an HDF5 data file |
---|
| 447 | :param key: class name data_point was taken from |
---|
| 448 | """ |
---|
| 449 | if key == u'shape': |
---|
| 450 | self.aperture.shape = data_point |
---|
| 451 | elif key == u'x_gap': |
---|
| 452 | self.aperture.size.x = data_point |
---|
| 453 | elif key == u'y_gap': |
---|
| 454 | self.aperture.size.y = data_point |
---|
| 455 | |
---|
| 456 | def process_source(self, data_point, key, unit): |
---|
| 457 | """ |
---|
| 458 | SASsource processor |
---|
| 459 | :param data_point: Single point from an HDF5 data file |
---|
| 460 | :param key: class name data_point was taken from |
---|
| 461 | :param unit: unit attribute from data set |
---|
| 462 | """ |
---|
| 463 | if key == u'incident_wavelength': |
---|
| 464 | self.current_datainfo.source.wavelength = data_point |
---|
| 465 | self.current_datainfo.source.wavelength_unit = unit |
---|
| 466 | elif key == u'wavelength_max': |
---|
| 467 | self.current_datainfo.source.wavelength_max = data_point |
---|
| 468 | self.current_datainfo.source.wavelength_max_unit = unit |
---|
| 469 | elif key == u'wavelength_min': |
---|
| 470 | self.current_datainfo.source.wavelength_min = data_point |
---|
| 471 | self.current_datainfo.source.wavelength_min_unit = unit |
---|
| 472 | elif key == u'incident_wavelength_spread': |
---|
| 473 | self.current_datainfo.source.wavelength_spread = data_point |
---|
| 474 | self.current_datainfo.source.wavelength_spread_unit = unit |
---|
| 475 | elif key == u'beam_size_x': |
---|
| 476 | self.current_datainfo.source.beam_size.x = data_point |
---|
| 477 | self.current_datainfo.source.beam_size_unit = unit |
---|
| 478 | elif key == u'beam_size_y': |
---|
| 479 | self.current_datainfo.source.beam_size.y = data_point |
---|
| 480 | self.current_datainfo.source.beam_size_unit = unit |
---|
| 481 | elif key == u'beam_shape': |
---|
| 482 | self.current_datainfo.source.beam_shape = data_point |
---|
| 483 | elif key == u'radiation': |
---|
| 484 | self.current_datainfo.source.radiation = data_point |
---|
| 485 | |
---|
| 486 | def process_process(self, data_point, key): |
---|
| 487 | """ |
---|
| 488 | SASprocess processor |
---|
| 489 | :param data_point: Single point from an HDF5 data file |
---|
| 490 | :param key: class name data_point was taken from |
---|
| 491 | """ |
---|
[ac38ab4] | 492 | term_match = re.compile(u'^term[0-9]+$') |
---|
[0d93464] | 493 | if key == u'Title': # CanSAS 2.0 |
---|
| 494 | self.process.name = data_point |
---|
| 495 | elif key == u'name': # NXcanSAS |
---|
| 496 | self.process.name = data_point |
---|
| 497 | elif key == u'description': |
---|
| 498 | self.process.description = data_point |
---|
| 499 | elif key == u'date': |
---|
| 500 | self.process.date = data_point |
---|
[ac38ab4] | 501 | elif term_match.match(key): |
---|
| 502 | self.process.term.append(data_point) |
---|
[0d93464] | 503 | else: |
---|
| 504 | self.process.notes.append(data_point) |
---|
| 505 | |
---|
[d72567e] | 506 | def add_intermediate(self): |
---|
[ad52d31] | 507 | """ |
---|
[082239e] | 508 | This method stores any intermediate objects within the final data set |
---|
| 509 | after fully reading the set. |
---|
[ad52d31] | 510 | |
---|
[082239e] | 511 | :param parent: The NXclass name for the h5py Group object that just |
---|
| 512 | finished being processed |
---|
[ad52d31] | 513 | """ |
---|
| 514 | |
---|
[d72567e] | 515 | if self.parent_class == u'SASprocess': |
---|
| 516 | self.current_datainfo.process.append(self.process) |
---|
[ad52d31] | 517 | self.process = Process() |
---|
[d72567e] | 518 | elif self.parent_class == u'SASdetector': |
---|
| 519 | self.current_datainfo.detector.append(self.detector) |
---|
[ad52d31] | 520 | self.detector = Detector() |
---|
[d72567e] | 521 | elif self.parent_class == u'SAStransmission_spectrum': |
---|
| 522 | self.current_datainfo.trans_spectrum.append(self.trans_spectrum) |
---|
[ad52d31] | 523 | self.trans_spectrum = TransmissionSpectrum() |
---|
[d72567e] | 524 | elif self.parent_class == u'SAScollimation': |
---|
| 525 | self.current_datainfo.collimation.append(self.collimation) |
---|
[ad52d31] | 526 | self.collimation = Collimation() |
---|
[d72567e] | 527 | elif self.parent_class == u'SASaperture': |
---|
[ad52d31] | 528 | self.collimation.aperture.append(self.aperture) |
---|
| 529 | self.aperture = Aperture() |
---|
[d72567e] | 530 | elif self.parent_class == u'SASdata': |
---|
[082239e] | 531 | if isinstance(self.current_dataset, plottable_2D): |
---|
[d72567e] | 532 | self.data2d.append(self.current_dataset) |
---|
[082239e] | 533 | elif isinstance(self.current_dataset, plottable_1D): |
---|
[802fc18] | 534 | if self.multi_frame: |
---|
[a165bee] | 535 | for x in range(0, len(self.data_frames)): |
---|
[802fc18] | 536 | self.current_dataset.y = self.data_frames[x] |
---|
| 537 | if len(self.data_uncertainty_frames) > x: |
---|
| 538 | self.current_dataset.dy = \ |
---|
| 539 | self.data_uncertainty_frames[x] |
---|
| 540 | self.data1d.append(self.current_dataset) |
---|
| 541 | else: |
---|
| 542 | self.data1d.append(self.current_dataset) |
---|
[68aa210] | 543 | |
---|
| 544 | def final_data_cleanup(self): |
---|
| 545 | """ |
---|
[082239e] | 546 | Does some final cleanup and formatting on self.current_datainfo and |
---|
| 547 | all data1D and data2D objects and then combines the data and info into |
---|
| 548 | Data1D and Data2D objects |
---|
[68aa210] | 549 | """ |
---|
[082239e] | 550 | # Type cast data arrays to float64 |
---|
[d72567e] | 551 | if len(self.current_datainfo.trans_spectrum) > 0: |
---|
[ad52d31] | 552 | spectrum_list = [] |
---|
[d72567e] | 553 | for spectrum in self.current_datainfo.trans_spectrum: |
---|
[ad52d31] | 554 | spectrum.transmission = spectrum.transmission.astype(np.float64) |
---|
[082239e] | 555 | spectrum.transmission_deviation = \ |
---|
| 556 | spectrum.transmission_deviation.astype(np.float64) |
---|
[ad52d31] | 557 | spectrum.wavelength = spectrum.wavelength.astype(np.float64) |
---|
[d72567e] | 558 | if len(spectrum.transmission) > 0: |
---|
| 559 | spectrum_list.append(spectrum) |
---|
| 560 | self.current_datainfo.trans_spectrum = spectrum_list |
---|
[68aa210] | 561 | |
---|
[082239e] | 562 | # Append errors to dataset and reset class errors |
---|
[d72567e] | 563 | self.current_datainfo.errors = self.errors |
---|
[282bc3f] | 564 | self.errors = [] |
---|
[68aa210] | 565 | |
---|
[082239e] | 566 | # Combine all plottables with datainfo and append each to output |
---|
| 567 | # Type cast data arrays to float64 and find min/max as appropriate |
---|
[d72567e] | 568 | for dataset in self.data2d: |
---|
[082239e] | 569 | # Calculate the actual Q matrix |
---|
[d72567e] | 570 | try: |
---|
| 571 | if dataset.q_data.size <= 1: |
---|
[54544637] | 572 | dataset.q_data = np.sqrt(dataset.qx_data |
---|
| 573 | * dataset.qx_data |
---|
| 574 | + dataset.qy_data |
---|
[109afbd] | 575 | * dataset.qy_data).flatten() |
---|
[d72567e] | 576 | except: |
---|
| 577 | dataset.q_data = None |
---|
[ac370c5] | 578 | |
---|
| 579 | if dataset.data.ndim == 2: |
---|
[c7c8143] | 580 | dataset.y_bins = np.unique(dataset.qy_data.flatten()) |
---|
| 581 | dataset.x_bins = np.unique(dataset.qx_data.flatten()) |
---|
[ac370c5] | 582 | dataset.data = dataset.data.flatten() |
---|
[4fdcc65] | 583 | dataset.qx_data = dataset.qx_data.flatten() |
---|
| 584 | dataset.qy_data = dataset.qy_data.flatten() |
---|
[c7c8143] | 585 | |
---|
| 586 | try: |
---|
| 587 | iter(dataset.mask) |
---|
| 588 | dataset.mask = np.invert(np.asarray(dataset.mask, dtype=bool)) |
---|
| 589 | except TypeError: |
---|
| 590 | dataset.mask = np.ones(dataset.data.shape, dtype=bool) |
---|
[9d786e5] | 591 | self.current_dataset = dataset |
---|
| 592 | self.send_to_output() |
---|
[d72567e] | 593 | |
---|
| 594 | for dataset in self.data1d: |
---|
[9d786e5] | 595 | self.current_dataset = dataset |
---|
| 596 | self.send_to_output() |
---|
[d72567e] | 597 | |
---|
[68aa210] | 598 | def add_data_set(self, key=""): |
---|
| 599 | """ |
---|
[082239e] | 600 | Adds the current_dataset to the list of outputs after preforming final |
---|
| 601 | processing on the data and then calls a private method to generate a |
---|
| 602 | new data set. |
---|
[68aa210] | 603 | |
---|
| 604 | :param key: NeXus group name for current tree level |
---|
| 605 | """ |
---|
[d72567e] | 606 | |
---|
| 607 | if self.current_datainfo and self.current_dataset: |
---|
[68aa210] | 608 | self.final_data_cleanup() |
---|
[802fc18] | 609 | self.data_frames = [] |
---|
| 610 | self.data_uncertainty_frames = [] |
---|
[d72567e] | 611 | self.data1d = [] |
---|
| 612 | self.data2d = [] |
---|
| 613 | self.current_datainfo = DataInfo() |
---|
[68aa210] | 614 | |
---|
[8f882fe] | 615 | def _initialize_new_data_set(self, value=None): |
---|
[68aa210] | 616 | """ |
---|
[082239e] | 617 | A private class method to generate a new 1D or 2D data object based on |
---|
| 618 | the type of data within the set. Outside methods should call |
---|
| 619 | add_data_set() to be sure any existing data is stored properly. |
---|
[68aa210] | 620 | |
---|
[d72567e] | 621 | :param parent_list: List of names of parent elements |
---|
[68aa210] | 622 | """ |
---|
[9220e89c] | 623 | if self._is_2d_not_multi_frame(value): |
---|
[d72567e] | 624 | self.current_dataset = plottable_2D() |
---|
[68aa210] | 625 | else: |
---|
| 626 | x = np.array(0) |
---|
| 627 | y = np.array(0) |
---|
[d72567e] | 628 | self.current_dataset = plottable_1D(x, y) |
---|
| 629 | self.current_datainfo.filename = self.raw_data.filename |
---|
[68aa210] | 630 | |
---|
[cf29187] | 631 | @staticmethod |
---|
[9220e89c] | 632 | def as_list_or_array(iterable): |
---|
| 633 | """ |
---|
| 634 | Return value as a list if not already a list or array. |
---|
| 635 | :param iterable: |
---|
| 636 | :return: |
---|
| 637 | """ |
---|
| 638 | if not (isinstance(iterable, np.ndarray) or isinstance(iterable, list)): |
---|
| 639 | iterable = iterable.split(",") if isinstance(iterable, basestring)\ |
---|
| 640 | else [iterable] |
---|
[cf29187] | 641 | return iterable |
---|
| 642 | |
---|
[9e0dd49] | 643 | def _find_data_attributes(self, value): |
---|
[2651724] | 644 | """ |
---|
| 645 | A class to find the indices for Q, the name of the Qdev and Idev, and |
---|
| 646 | the name of the mask. |
---|
| 647 | :param value: SASdata/NXdata HDF5 Group |
---|
| 648 | """ |
---|
[802fc18] | 649 | # Initialize values to base types |
---|
| 650 | self.mask_name = u'' |
---|
| 651 | self.i_name = u'' |
---|
| 652 | self.i_node = u'' |
---|
| 653 | self.i_uncertainties_name = u'' |
---|
| 654 | self.q_names = [] |
---|
| 655 | self.q_uncertainty_names = [] |
---|
| 656 | self.q_resolution_names = [] |
---|
| 657 | # Get attributes |
---|
[9e0dd49] | 658 | attrs = value.attrs |
---|
[0bd8fac] | 659 | signal = attrs.get("signal", "I") |
---|
| 660 | i_axes = attrs.get("I_axes", ["Q"]) |
---|
| 661 | q_indices = attrs.get("Q_indices", [0]) |
---|
[9220e89c] | 662 | i_axes = self.as_list_or_array(i_axes) |
---|
[9e0dd49] | 663 | keys = value.keys() |
---|
[802fc18] | 664 | # Assign attributes to appropriate class variables |
---|
[9220e89c] | 665 | self.q_names = [i_axes[int(v)] for v in self.as_list_or_array(q_indices)] |
---|
[18af6d2] | 666 | self.mask_name = attrs.get("mask") |
---|
[9e0dd49] | 667 | self.i_name = signal |
---|
[2651724] | 668 | self.i_node = value.get(self.i_name) |
---|
[b204004] | 669 | for item in self.q_names: |
---|
[2651724] | 670 | if item in keys: |
---|
| 671 | q_vals = value.get(item) |
---|
[0bd8fac] | 672 | if q_vals.attrs.get("uncertainties") is not None: |
---|
[b204004] | 673 | self.q_uncertainty_names = q_vals.attrs.get("uncertainties") |
---|
[0bd8fac] | 674 | elif q_vals.attrs.get("uncertainty") is not None: |
---|
[b204004] | 675 | self.q_uncertainty_names = q_vals.attrs.get("uncertainty") |
---|
| 676 | if isinstance(self.q_uncertainty_names, basestring): |
---|
| 677 | self.q_uncertainty_names = self.q_uncertainty_names.split(",") |
---|
[0bd8fac] | 678 | if q_vals.attrs.get("resolutions") is not None: |
---|
[b204004] | 679 | self.q_resolution_names = q_vals.attrs.get("resolutions") |
---|
| 680 | if isinstance(self.q_resolution_names, basestring): |
---|
| 681 | self.q_resolution_names = self.q_resolution_names.split(",") |
---|
[9e0dd49] | 682 | if self.i_name in keys: |
---|
| 683 | i_vals = value.get(self.i_name) |
---|
[b204004] | 684 | self.i_uncertainties_name = i_vals.attrs.get("uncertainties") |
---|
| 685 | if self.i_uncertainties_name is None: |
---|
| 686 | self.i_uncertainties_name = i_vals.attrs.get("uncertainty") |
---|
[9e0dd49] | 687 | |
---|
[9220e89c] | 688 | def _is_2d_not_multi_frame(self, value, i_base="", q_base=""): |
---|
[ad52d31] | 689 | """ |
---|
[8f882fe] | 690 | A private class to determine if the data set is 1d or 2d. |
---|
[ad52d31] | 691 | |
---|
[802fc18] | 692 | :param value: Nexus/NXcanSAS data group |
---|
[d72567e] | 693 | :param basename: Approximate name of an entry to search for |
---|
[8f882fe] | 694 | :return: True if 2D, otherwise false |
---|
| 695 | """ |
---|
[802fc18] | 696 | i_basename = i_base if i_base != "" else self.i_name |
---|
| 697 | i_vals = value.get(i_basename) |
---|
[9220e89c] | 698 | q_basename = q_base if q_base != "" else self.q_names |
---|
[802fc18] | 699 | q_vals = value.get(q_basename[0]) |
---|
[9220e89c] | 700 | self.multi_frame = (i_vals is not None and q_vals is not None |
---|
| 701 | and len(i_vals.shape) != 1 |
---|
| 702 | and len(q_vals.shape) == 1) |
---|
| 703 | return (i_vals is not None and len(i_vals.shape) != 1 |
---|
| 704 | and not self.multi_frame) |
---|
[ad52d31] | 705 | |
---|
[68aa210] | 706 | def _create_unique_key(self, dictionary, name, numb=0): |
---|
| 707 | """ |
---|
| 708 | Create a unique key value for any dictionary to prevent overwriting |
---|
| 709 | Recurses until a unique key value is found. |
---|
| 710 | |
---|
| 711 | :param dictionary: A dictionary with any number of entries |
---|
| 712 | :param name: The index of the item to be added to dictionary |
---|
| 713 | :param numb: The number to be appended to the name, starts at 0 |
---|
[d72567e] | 714 | :return: The new name for the dictionary entry |
---|
[68aa210] | 715 | """ |
---|
| 716 | if dictionary.get(name) is not None: |
---|
| 717 | numb += 1 |
---|
| 718 | name = name.split("_")[0] |
---|
| 719 | name += "_{0}".format(numb) |
---|
| 720 | name = self._create_unique_key(dictionary, name, numb) |
---|
[d398285] | 721 | return name |
---|
| 722 | |
---|
| 723 | def _get_unit(self, value): |
---|
| 724 | """ |
---|
| 725 | Find the unit for a particular value within the h5py dictionary |
---|
| 726 | |
---|
| 727 | :param value: attribute dictionary for a particular value set |
---|
[d72567e] | 728 | :return: unit for the value passed to the method |
---|
[d398285] | 729 | """ |
---|
[5c5e7fd] | 730 | unit = h5attr(value, u'units') |
---|
[54544637] | 731 | if unit is None: |
---|
[5c5e7fd] | 732 | unit = h5attr(value, u'unit') |
---|
[54ba66e] | 733 | return unit |
---|