ObjCryst::MolZAtom Struct Reference
Light-weight representation of an atom in the molecule, as a part of a Z-matrix.
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Collaboration diagram for ObjCryst::MolZAtom:
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Detailed Description
Light-weight representation of an atom in the molecule, as a part of a Z-matrix.
This is used to export the Molecule structure to a z-matrix.
- Todo:
- : some flags could be added to mark the fixed/limited nature of the parameters.
Member Data Documentation
The documentation for this struct was generated from the following file:
Generated on Tue Nov 14 15:04:14 2006 for ObjCryst++ by
1.3.6