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1 ############################################################################# 2 # # 3 # The BMRB library. # 4 # # 5 # Copyright (C) 2009-2011 Edward d'Auvergne # 6 # # 7 # This program is free software: you can redistribute it and/or modify # 8 # it under the terms of the GNU General Public License as published by # 9 # the Free Software Foundation, either version 3 of the License, or # 10 # (at your option) any later version. # 11 # # 12 # This program is distributed in the hope that it will be useful, # 13 # but WITHOUT ANY WARRANTY; without even the implied warranty of # 14 # MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the # 15 # GNU General Public License for more details. # 16 # # 17 # You should have received a copy of the GNU General Public License # 18 # along with this program. If not, see <http://www.gnu.org/licenses/>. # 19 # # 20 ############################################################################# 21 22 # Module docstring. 23 """The NMR-STAR dictionary API for version 3.1. 24 25 The v3.1 NMR-STAR dictionary is documented at 26 http://www.bmrb.wisc.edu/dictionary/3.1html/SuperGroupPage.html. 27 """ 28 29 # relax module imports. 30 from bmrblib.assembly_supercategory.entity_v3_1 import EntitySaveframe_v3_1 31 from bmrblib.citations.citations_v3_1 import CitationsSaveframe_v3_1 32 from bmrblib.experimental_details.experiment_v3_1 import ExperimentSaveframe_v3_1 33 from bmrblib.experimental_details.method_v3_1 import MethodSaveframe_v3_1 34 from bmrblib.experimental_details.nmr_spectrometer_v3_1 import NMRSpectrometerSaveframe_v3_1 35 from bmrblib.experimental_details.sample_conditions_v3_1 import SampleConditionsSaveframe_v3_1 36 from bmrblib.experimental_details.software_v3_1 import SoftwareSaveframe_v3_1 37 from bmrblib.kinetics.relaxation import Relaxation_v3_1 38 from bmrblib.NMR_parameters.chem_shift_anisotropy_v3_1 import ChemShiftAnisotropySaveframe_v3_1 39 from bmrblib.structure.tensor import TensorSaveframe 40 from bmrblib.thermodynamics.model_free_v3_1 import ModelFreeSaveframe_v3_1 41 from bmrblib.nmr_star_dict import NMR_STAR 42 4345 """The v3.1 NMR-STAR dictionary.""" 467448 """Create all the saveframe objects.""" 49 50 # Initialise Supergroup 2: The citations. 51 self.citations = CitationsSaveframe_v3_1(self.data.datanodes) 52 53 # Initialise Supergroup 3: The molecular assembly saveframe API. 54 self.entity = EntitySaveframe_v3_1(self.data.datanodes) 55 56 # Initialise Supergroup 4: The experimental descriptions saveframe API. 57 self.experiment = ExperimentSaveframe_v3_1(self.data.datanodes) 58 self.method = MethodSaveframe_v3_1(self.data.datanodes) 59 self.nmr_spectrometer = NMRSpectrometerSaveframe_v3_1(self.data.datanodes) 60 self.sample_conditions = SampleConditionsSaveframe_v3_1(self.data.datanodes) 61 self.software = SoftwareSaveframe_v3_1(self.data.datanodes) 62 63 # Initialise Supergroup 5: The NMR parameters saveframe API. 64 self.chem_shift_anisotropy = ChemShiftAnisotropySaveframe_v3_1(self.data.datanodes) 65 66 # Initialise Supergroup 6: The kinetic data saveframe API. 67 self.relaxation = Relaxation_v3_1(self.data.datanodes) 68 69 # Initialise Supergroup 7: The thermodynamics saveframe API. 70 self.model_free = ModelFreeSaveframe_v3_1(self.data.datanodes) 71 72 # Initialise Supergroup 8: The structure determination saveframes. 73 self.tensor = TensorSaveframe(self.data.datanodes)
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