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Rosetta
2016.11
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#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... | |
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default constructor to initialize all values
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inline |
References A_.
Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::simple_moves::PeriodicBoxMover::apply(), protocols::hybridization::HybridizeProtocol::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::cryst::MakeLatticeMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file_op(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::dump_ASU(), protocols::simple_moves::PeriodicBoxMover::setup_pose(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().
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References alpha_.
Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::MakeLatticeMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file_op(), protocols::cryst::crystRMSfast(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().
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References B_.
Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::hybridization::HybridizeProtocol::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::cryst::MakeLatticeMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file_op(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::setup_pose(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().
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References beta_.
Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::cryst::MakeLatticeMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file_op(), protocols::cryst::crystRMSfast(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().
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References C_.
Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::hybridization::HybridizeProtocol::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::cryst::MakeLatticeMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file_op(), protocols::cryst::crystRMSfast(), protocols::simple_moves::PeriodicBoxMover::setup_pose(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().
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References gamma_.
Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::cryst::MakeLatticeMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file_op(), protocols::cryst::crystRMSfast(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().
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References spacegroup_.
Referenced by protocols::cryst::UpdateCrystInfo::apply(), protocols::cryst::MakeLayerMover::apply(), protocols::cryst::MakeLatticeMover::apply(), core::io::pdb::create_records_from_sfr(), core::io::mmcif::create_sfr_from_cif_file_op(), protocols::cryst::crystRMSfast(), and core::io::pdb::store_crystallographic_parameter_record_in_sfr().
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References spacegroup_.
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friend |
Debug printing, serialazing to Tracer like object.
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private |
For now, all member names have the same names as fields in PDB standard.
Referenced by A().
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private |
Referenced by spacegroup().