def create(cls, *atoms):
"""
Creates the label if it doesn't exist.
"""
atomids = tuple(a.index for a in atoms)
molids = tuple(a.molecule.molid for a in atoms)
_label.add(cls._category, molids, atomids)
return cls(*atoms)
def create(cls, *atoms):
"""
Creates the label if it doesn't exist.
"""
atomids = tuple(a.index for a in atoms)
molids = tuple(a.molecule.molid for a in atoms)
_label.add(cls._category, molids, atomids)
return cls(*atoms)
def update(self):
""" Updates the values of the 'on' and 'value' attributes for this label.
"""
self.__dict__.update(label.add(self.type, self.molid, self.atomid))
def __init__(self, type, molid, atomid):
self.type = type
self.__dict__.update(label.add(self.type, molid, atomid))
def update(self): """ Updates the values of the 'on' and 'value' attributes for this label. """ self.__dict__.update(label.add(self.type, self.molid, self.atomid))
def __init__(self, type, molid, atomid): self.type = type self.__dict__.update(label.add(self.type, molid, atomid))