8 #include "McConfigIo.h" 9 #include <mcMd/chemistry/Atom.h> 42 { out << atom.
position() << std::endl; }
Boundary & boundary() const
Get the Boundary.
A set of interacting Molecules enclosed by a Boundary.
McConfigIo(System &system)
Constructor.
Base class for default Mc and Md configIos.
A point particle within a Molecule.
Utility classes for scientific computation.
void shift(Vector &r) const
Shift Cartesian Vector r to its primary image.
virtual void readAtom(std::istream &out, Atom &atom)
Read data for one atom.
virtual void writeAtom(std::ostream &out, const Atom &atom)
Write data for one atom.
Single-processor Monte Carlo (MC) and molecular dynamics (MD).
virtual ~McConfigIo()
Destructor.
const Vector & position() const
Get the position Vector by const reference.