OEAnisoUij¶

class OEAnisoUij

The OEAnisoUij class is a simple container used to package anisotropic B-factor parameters that can be associated with an OEAtomBase object. Using one can make accessing Uij values easier in wrapped languages.

Constructors¶

OEAnisoUij()
OEAnisoUij(int u11, int u22, int u33, int u12, int u13, int u23)

Default constructor (which sets all parameters to 0) and constructor that takes specific values for each parameter.

GetU11¶

int GetU11() const

GetU12¶

int GetU12() const

GetU13¶

int GetU13() const

GetU22¶

int GetU22() const

GetU23¶

int GetU23() const

GetU33¶

int GetU33() const

SetU11¶

void SetU11(int val)

SetU12¶

void SetU12(int val)

SetU13¶

void SetU13(int val)

SetU22¶

void SetU22(int val)

SetU23¶

void SetU23(int val)

SetU33¶

void SetU33(int val)