mrmd::io::DumpH5MD Class Reference

#include <io/DumpH5MD.hpp>

Public Member Functions
	DumpH5MD (const std::string &authorArg, const std::string &particleGroupNameArg="atoms")
	DumpH5MD (const DumpH5MD &)=delete
DumpH5MD &	operator= (const DumpH5MD &)=delete
	DumpH5MD (DumpH5MD &&)=delete
DumpH5MD &	operator= (DumpH5MD &&)=delete
void	open (const std::string &filename, const data::Subdomain &subdomain, const data::Atoms &atoms)
void	dumpStep (const data::Subdomain &subdomain, const data::Atoms &atoms, const idx_t step, const real_t dt)
void	close ()
void	dump (const std::string &filename, const data::Subdomain &subdomain, const data::Atoms &atoms)

Public Attributes
bool	dumpPos = true
bool	dumpVel = true
bool	dumpForce = true
bool	dumpType = true
bool	dumpMass = true
bool	dumpCharge = true
bool	dumpRelativeMass = true
std::string	posDataset = "position"
std::string	velDataset = "velocity"
std::string	forceDataset = "force"
std::string	typeDataset = "type"
std::string	massDataset = "mass"
std::string	chargeDataset = "charge"
std::string	relativeMassDataset = "relativeMass"
std::string	author = "xxx"
std::string	particleGroupName = "atoms"

Friends
class	impl::DumpH5MDImpl

Constructor & Destructor Documentation

DumpH5MD() [1/3]

mrmd::io::DumpH5MD::DumpH5MD	(	const std::string &	authorArg,
		const std::string &	particleGroupNameArg = "atoms"
	)

DumpH5MD() [2/3]

mrmd::io::DumpH5MD::DumpH5MD ( const DumpH5MD &  )

delete

DumpH5MD() [3/3]

mrmd::io::DumpH5MD::DumpH5MD ( DumpH5MD &&  )

delete

Member Function Documentation

close()

void mrmd::io::DumpH5MD::close

(

)

dump()

void mrmd::io::DumpH5MD::dump	(	const std::string &	filename,
		const data::Subdomain &	subdomain,
		const data::Atoms &	atoms
	)

dumpStep()

void mrmd::io::DumpH5MD::dumpStep	(	const data::Subdomain &	subdomain,
		const data::Atoms &	atoms,
		const idx_t	step,
		const real_t	dt
	)

open()

void mrmd::io::DumpH5MD::open	(	const std::string &	filename,
		const data::Subdomain &	subdomain,
		const data::Atoms &	atoms
	)

operator=() [1/2]

DumpH5MD & mrmd::io::DumpH5MD::operator= ( const DumpH5MD &  )

delete

operator=() [2/2]

DumpH5MD & mrmd::io::DumpH5MD::operator= ( DumpH5MD &&  )

delete

Friends And Related Symbol Documentation

impl::DumpH5MDImpl

friend class impl::DumpH5MDImpl

friend

Member Data Documentation

author

std::string mrmd::io::DumpH5MD::author = "xxx"

chargeDataset

std::string mrmd::io::DumpH5MD::chargeDataset = "charge"

dumpCharge

bool mrmd::io::DumpH5MD::dumpCharge = true

dumpForce

bool mrmd::io::DumpH5MD::dumpForce = true

dumpMass

bool mrmd::io::DumpH5MD::dumpMass = true

dumpPos

bool mrmd::io::DumpH5MD::dumpPos = true

dumpRelativeMass

bool mrmd::io::DumpH5MD::dumpRelativeMass = true

dumpType

bool mrmd::io::DumpH5MD::dumpType = true

dumpVel

bool mrmd::io::DumpH5MD::dumpVel = true

forceDataset

std::string mrmd::io::DumpH5MD::forceDataset = "force"

massDataset

std::string mrmd::io::DumpH5MD::massDataset = "mass"

particleGroupName

std::string mrmd::io::DumpH5MD::particleGroupName = "atoms"

posDataset

std::string mrmd::io::DumpH5MD::posDataset = "position"

relativeMassDataset

std::string mrmd::io::DumpH5MD::relativeMassDataset = "relativeMass"

typeDataset

std::string mrmd::io::DumpH5MD::typeDataset = "type"

velDataset

std::string mrmd::io::DumpH5MD::velDataset = "velocity"

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The documentation for this class was generated from the following files:

• mrmd/io/DumpH5MD.hpp
• mrmd/io/DumpH5MD.cpp