def registry(): """ This function pass to the noodles infrascture all the information related to the Structure of the Package object that is schedule. This *Registry* class contains hints that help Noodles to encode and decode this Package object. """ return Registry(parent=serial.base() + arrays_to_hdf5())
def registry(): """ This function pass to the noodles infrascture all the information related to the Structure of the Package object that is schedule. This *Registry* class contains hints that help Noodles to encode and decode this Package object. """ return Registry(parent=serial.base() + arrays_to_hdf5(), types={ Package: AsDict(Package), Path: SerPath(), plams.Molecule: SerMolecule(), Chem.Mol: SerMol(), Result: SerStorable(Result), Settings: SerSettings() })
def registry(): """ This function pass to the noodles infrascture all the information related to the Structure of the Package object that is schedule. This *Registry* class contains hints that help Noodles to encode and decode this Package object. """ return Registry( parent=serial.base() + arrays_to_hdf5(), types={ Package: AsDict(Package), Path: SerPath(), plams.Molecule: SerMolecule(), Chem.Mol: SerMol(), Result: AsDict(Result), Settings: SerSettings(), plams.KFFile: SerReasonableObject(plams.KFFile), plams.KFReader: SerReasonableObject(plams.KFReader), np.floating: SerNumpyScalar(), np.integer: SerNumpyScalar() } )
def registry(): return serial.base() + arrays_to_hdf5()
workdir = plams.config.get('default_jobmanager').workdir except AttributeError as ex: raise plams.PlamsError( "Failed to initialize the PLAMS jobmanager") from ex db_file = join(workdir, 'cache.db') return run_parallel(wf, n_threads=n_processes, registry=registry, db_file=db_file, always_cache=always_cache, echo_log=False) #: A :class:`Registry` instance to-be returned by :func:`registry`. REGISTRY: Registry = Registry(parent=serial.base() + arrays_to_hdf5(), types={ Package: SerReduce(Package), Path: SerPath(), plams.Molecule: SerMolecule(), Chem.Mol: SerMol(), Result: AsDict(Result), Settings: SerSettings(), plams.KFFile: SerReasonableObject(plams.KFFile),
def registry(): return serial.base() + arrays_to_hdf5()