Package schrodinger :: Module structure :: Class _StructureAtomProperty

Class _StructureAtomProperty

UserDict.DictMixin --+
                     |
                    _StructureAtomProperty

Dictionary-like container of atom based properties. These can be accessed via the property name as it appears in the maestro file.

Property names must be m2io data names, which are in the format '<type>_<author>_<property_name>', where '<type>' is a data type prefix, '<author>' is a source specification, and '<property_name>' is the actual name of the data.

The data type prefix can specified as 's' for string, 'i' for integer, 'r' for real and 'b' for boolean. The author specification should be 'user' for user created properties. The property name can have embedded underscores.

Some example m2io datanames are 'r_m_x_coord', which indicates a real maestro property named 'x coord', and 'i_user_my_count' which indicates an integer user property named 'my count'.

Instance Methods

[hide private]

__init__(self, ct, cpp_atom)
Create an instance of the property dictionary.

__getitem__(self, item)
Return the given item if it is a valid property for this atom, None if not.

__setitem__(self, item, value)
Set atom properties for the given atom:

__delitem__(self, item)
Delete the atom property.

keys(self)
Returns a list of the datanames of all unrequested items.

Inherited from UserDict.DictMixin: __cmp__, __contains__, __iter__, __len__, __repr__, clear, get, has_key, items, iteritems, iterkeys, itervalues, pop, popitem, setdefault, update, values