coordinatefile.h File Reference

#include <memory>
#include <string>
#include <utility>
#include <vector>
#include "gromacs/coordinateio/ioutputadapter.h"
#include "gromacs/coordinateio/outputadaptercontainer.h"
#include "gromacs/math/vectypes.h"
#include "gromacs/topology/atoms.h"

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Description

CoordinateFile takes care of opening files and writing output to them.

Author

Classes
class	gmx::TrajectoryFileOpener
	Low level method to take care of only file opening and closing. More...
class	gmx::TrajectoryFrameWriter
	Writes coordinate frames to a sink, e.g. a trajectory file. More...

Typedefs
using	gmx::TrajectoryFrameWriterPointer = std::unique_ptr< TrajectoryFrameWriter >
	Smart pointer to manage the TrajectoryFrameWriter object.

Functions
std::unique_ptr < TrajectoryFrameWriter >	gmx::createTrajectoryFrameWriter (const gmx_mtop_t *top, const Selection &sel, const std::string &filename, AtomsDataPtr atoms, OutputRequirements requirements)
	Factory function for TrajectoryFrameWriter. More...