Gromacs  2025-dev-20240717-76b059a
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simulationcontext.h File Reference
#include <memory>
#include <string>
#include "gromacs/mdrunutility/multisim.h"
#include "gromacs/utility/gmxmpi.h"
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Provide ways for client code to own simulation resources.

For gmx mdrun to be implemented as a client program, public API needs to provide a way to create and manipulate the SimulationContext.

M. Eric Irrgang


class  gmx::ArrayRef< typename >
 STL-like interface to a C array of T (or part of a std container of T). More...
class  gmx::SimulationContext
 Simulation environment and configuration. More...