#include <CrystInfo.hh>

Public Member Functions
	CrystInfo ()
	default constructor to initialize all values More...

Real	A () const

void	A (Real Ain)

Real	B () const

void	B (Real Bin)

Real	C () const

void	C (Real Cin)

Real	alpha () const

void	alpha (Real alphain)

Real	beta () const

void	beta (Real betain)

Real	gamma () const

void	gamma (Real gammain)

std::string	spacegroup () const

void	spacegroup (std::string spacegroupin)

Private Attributes
Real	A_
	For now, all member names have the same names as fields in PDB standard. More...

Real	B_

Real	C_

Real	alpha_

Real	beta_

Real	gamma_

std::string	spacegroup_

Friends
std::ostream &	operator<< (std::ostream &os, CrystInfo const &ci)
	Debug printing, serialazing to Tracer like object. More...

Constructor & Destructor Documentation

◆ CrystInfo()

core::io::CrystInfo::CrystInfo ( )

inline

default constructor to initialize all values

Member Function Documentation

◆ A() [1/2]

Real core::io::CrystInfo::A ( ) const

inline

References A_.

Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::CrystRMS::apply(), protocols::cryst::DockLatticeMover::apply(), protocols::cryst::MakeLatticeMover::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::cryst::DockLatticeMover::initialize(), protocols::cryst::DockLatticeMover::regenerate_lattice(), protocols::simple_moves::PeriodicBoxMover::setup_pose(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().

◆ A() [2/2]

void core::io::CrystInfo::A ( Real Ain )

inline

References A_.

◆ alpha() [1/2]

Real core::io::CrystInfo::alpha ( ) const

inline

References alpha_.

Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::CrystRMS::apply(), protocols::cryst::MakeLatticeMover::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::cryst::DockLatticeMover::initialize(), protocols::cryst::DockLatticeMover::regenerate_lattice(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().

◆ alpha() [2/2]

void core::io::CrystInfo::alpha ( Real alphain )

inline

References alpha_.

◆ B() [1/2]

Real core::io::CrystInfo::B ( ) const

inline

References B_.

Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::CrystRMS::apply(), protocols::cryst::DockLatticeMover::apply(), protocols::cryst::MakeLatticeMover::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::cryst::DockLatticeMover::initialize(), protocols::cryst::DockLatticeMover::regenerate_lattice(), protocols::simple_moves::PeriodicBoxMover::setup_pose(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().

◆ B() [2/2]

void core::io::CrystInfo::B ( Real Bin )

inline

References B_.

◆ beta() [1/2]

Real core::io::CrystInfo::beta ( ) const

inline

References beta_.

Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::CrystRMS::apply(), protocols::cryst::MakeLatticeMover::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::cryst::DockLatticeMover::initialize(), protocols::cryst::DockLatticeMover::regenerate_lattice(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().

◆ beta() [2/2]

void core::io::CrystInfo::beta ( Real betain )

inline

References beta_.

◆ C() [1/2]

Real core::io::CrystInfo::C ( ) const

inline

References C_.

Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::CrystRMS::apply(), protocols::cryst::DockLatticeMover::apply(), protocols::cryst::MakeLatticeMover::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::cryst::DockLatticeMover::initialize(), protocols::cryst::DockLatticeMover::regenerate_lattice(), protocols::simple_moves::PeriodicBoxMover::setup_pose(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().

◆ C() [2/2]

void core::io::CrystInfo::C ( Real Cin )

inline

References C_.

◆ gamma() [1/2]

Real core::io::CrystInfo::gamma ( ) const

inline

References gamma_.

Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::CrystRMS::apply(), protocols::cryst::MakeLatticeMover::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::cryst::DockLatticeMover::initialize(), protocols::cryst::DockLatticeMover::regenerate_lattice(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().

◆ gamma() [2/2]

void core::io::CrystInfo::gamma ( Real gammain )

inline

References gamma_.

◆ spacegroup() [1/2]

std::string core::io::CrystInfo::spacegroup ( ) const

inline

References spacegroup_.

Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::CrystRMS::apply(), protocols::cryst::MakeLatticeMover::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::cryst::DockLatticeMover::initialize(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().

◆ spacegroup() [2/2]

void core::io::CrystInfo::spacegroup ( std::string spacegroupin )

inline

References spacegroup_.

Friends And Related Function Documentation

◆ operator<<

std::ostream& operator<<	(	std::ostream &	os,
		CrystInfo const &	ci
	)

friend

Debug printing, serialazing to Tracer like object.

Member Data Documentation

◆ A_

Real core::io::CrystInfo::A_

private

For now, all member names have the same names as fields in PDB standard.

Referenced by A().

◆ alpha_

Real core::io::CrystInfo::alpha_

private

Referenced by alpha().

◆ B_

Real core::io::CrystInfo::B_

private

Referenced by B().

◆ beta_

Real core::io::CrystInfo::beta_

private

Referenced by beta().

◆ C_

Real core::io::CrystInfo::C_

private

Referenced by C().

◆ gamma_

Real core::io::CrystInfo::gamma_

private

Referenced by gamma().

◆ spacegroup_

std::string core::io::CrystInfo::spacegroup_

private

Referenced by spacegroup().

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

src/core/io/CrystInfo.hh

Public Member Functions

Private Attributes

Friends

Constructor & Destructor Documentation

◆ CrystInfo()

Member Function Documentation

◆ A() [1/2]

◆ A() [2/2]

◆ alpha() [1/2]

◆ alpha() [2/2]

◆ B() [1/2]

◆ B() [2/2]

◆ beta() [1/2]

◆ beta() [2/2]

◆ C() [1/2]

◆ C() [2/2]

◆ gamma() [1/2]

◆ gamma() [2/2]

◆ spacegroup() [1/2]

◆ spacegroup() [2/2]

Friends And Related Function Documentation

◆ operator<<

Member Data Documentation

◆ A_

◆ alpha_

◆ B_

◆ beta_

◆ C_

◆ gamma_

◆ spacegroup_