OESetRotamerΒΆ

bool OESetRotamer(OEHierResidue &residue, const OERotamer &rotamer)

bool OESetRotamer(OEAtomBase &atom, const OERotamer &rotamer)

Sets the \(\chi\) angles for the atoms in the specified residue. The angels are defined in the OERotamer object while the residue is specified either by an OEHierResidue object or by one of the atoms of the residue (OEAtomBase).

See also