void OESetAnisou(OEAtomBase *atom, const OEAnisoUij &uij)
void OESetAnisou(OEAtomBase *atom, int u11, int u22, int u33,
int u12, int u13, int u23)
This function is used to set the anisotropic B-factor parameters associated with an OEAtomBase.
The form that uses a OEAnisoUij accesses the data packaged within the object.
See also