OEGetAnisou

OEGetAnisou(uij: OEAnisoUij, atom: OEAtomBase) -> bool
OEGetAnisou(atom: OEAtomBase, u11: int, u22: int, u33: int, u12: int,
            u13: int, u23: int) -> bool

This function is used to return anisotropic B-factor parameters associated with an OEAtomBase from a PDB file read with the flavor OEIFlavor_PDB_DATA.

If the atom does not have associated anisotropic B-factor parameters, returns false and sets all the parameter values to 0. The predicate OEHasAnisou can be used to check for parameters.

The form that uses a OEAnisoUij returns the data in packaged form for convenience in wrapped languages.