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AtomInMolblock Struct Reference


Container for returning molecule type and index information for an atom.

Public Attributes

int molblockIndex
 The index into the molecule block array.
int moleculeType
 The molecule type.
int moleculeIndex
 The index of the molecule in the molecule block.
int atomIndexInMolecule
 The index of the atom in the molecule.

The documentation for this struct was generated from the following file: