BALL  1.4.79
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BALL::NMRStarFile Member List

This is the complete list of members for BALL::NMRStarFile, including all inherited members.

addMonomericPolymer(MonomericPolymer mp)BALL::NMRStarFile
assignShifts(BALLToBMRBMapper &ball_to_bmrb_mapping)BALL::NMRStarFile
assignShifts(AtomContainer &ac, const String &chemical_unit, const String &aligned_ball_sequence, const String &aligned_nmrstar_sequence)BALL::NMRStarFile
CIFFile()BALL::CIFFile
CIFFile(const String &filename, File::OpenMode open_mode=std::ios::in)BALL::CIFFile
clear()BALL::NMRStarFilevirtual
clearParameters()BALL::CIFFile
close()BALL::File
copy(String source_name, String destination_name, Size buffer_size=4096)BALL::Filestatic
copyTo(const String &destination_name, Size buffer_size=4096)BALL::File
created_temp_filenames_BALL::Fileprotectedstatic
createTemporaryFilename(String &temporary, const String &suffix=".TMP")BALL::Filestatic
current_datablock_BALL::CIFFileprotected
current_item_BALL::CIFFileprotected
current_saveframe_BALL::CIFFileprotected
datablocks_BALL::CIFFileprotected
datablocks_hash_BALL::CIFFileprotected
disableTransformation(Transformation transformation)BALL::Filestatic
enableTransformation(Transformation transformation)BALL::Filestatic
File()BALL::File
File(const String &name, OpenMode open_mode=std::ios::in)BALL::File
FLOAT_VALUE_NABALL::NMRStarFilestatic
getChemicalUnitByLabel(String const &label) const BALL::NMRStarFile
getChemicalUnitByLabel(String const &label)BALL::NMRStarFile
getDatablock(const String &name) const BALL::CIFFile
getDatablock(const String &name)BALL::CIFFile
getEntryInformation() const BALL::NMRStarFileinline
getFileStream()BALL::File
getMolecularInformation() const BALL::NMRStarFileinline
getMolecularInformation()BALL::NMRStarFileinline
getMonomericPolymer(Position i)BALL::NMRStarFile
getMonomericPolymer(Position i) const BALL::NMRStarFile
getMonomericPolymer(const String &name)BALL::NMRStarFile
getMonomericPolymer(const String &name) const BALL::NMRStarFile
getMonomericPolymers() const BALL::NMRStarFileinline
getName() const BALL::File
getNMRData() const BALL::NMRStarFile
getNMRSpectrometer(Position i)BALL::NMRStarFile
getNMRSpectrometer(Position i) const BALL::NMRStarFile
getNMRSpectrometerByName(String name)BALL::NMRStarFile
getNMRSpectrometerByName(String name) const BALL::NMRStarFile
getNMRSpectrometerFieldStrength(Position i) const BALL::NMRStarFile
getNMRSpectrometerManufacturer(Position i) const BALL::NMRStarFile
getNMRSpectrometers()BALL::NMRStarFileinline
getNMRSpectrometers() const BALL::NMRStarFileinline
getNumberOfAtoms() const BALL::NMRStarFile
getNumberOfMonomericPolymers() const BALL::NMRStarFileinline
getNumberOfNMRSpectrometers() const BALL::NMRStarFileinline
getNumberOfSampleConditions() const BALL::NMRStarFileinline
getNumberOfSamples() const BALL::NMRStarFileinline
getNumberOfShiftReferenceSets() const BALL::NMRStarFileinline
getNumberOfShiftsAssigned() const BALL::NMRStarFileinline
getOpenMode() const BALL::File
getOriginalName() const BALL::File
getResidueSequence(Position i=0) const BALL::NMRStarFile
getSample(Position i) const BALL::NMRStarFile
getSample(String label) const BALL::NMRStarFile
getSampleCondition(Position i)BALL::NMRStarFileinline
getSampleCondition(Position i) const BALL::NMRStarFileinline
getSampleConditionByName(String name)BALL::NMRStarFile
getSampleConditionByName(String name) const BALL::NMRStarFile
getSampleConditions() const BALL::NMRStarFileinline
getSampleConditions()BALL::NMRStarFileinline
getSamples() const BALL::NMRStarFileinline
getShiftReferenceSet(Position i)BALL::NMRStarFileinline
getShiftReferenceSet(Position i) const BALL::NMRStarFileinline
getShiftReferenceSetByName(String name) const BALL::NMRStarFile
getShiftReferenceSetByName(String name)BALL::NMRStarFile
getShiftReferenceSets()BALL::NMRStarFileinline
getShiftReferenceSets() const BALL::NMRStarFileinline
getSize()BALL::File
getSize(String name)BALL::Filestatic
getTransformationManager()BALL::File
getTransformationManager() const BALL::File
getType(String name, bool trace_link)BALL::Filestatic
getType(bool trace_link) const BALL::File
hasCshifts() const BALL::NMRStarFileinline
hasDatablock(const String &name) const BALL::CIFFile
hasHshifts() const BALL::NMRStarFileinline
hasMonomericPolymer(String name) const BALL::NMRStarFile
hasNshifts() const BALL::NMRStarFileinline
hasSample(String label) const BALL::NMRStarFile
hasSampleCondition(String name)BALL::NMRStarFile
hasSampleCondition(String name) const BALL::NMRStarFile
hasShiftReferenceSet(String name)BALL::NMRStarFile
inDatablock(const char *name)BALL::CIFFile
inItem(const char *name)BALL::CIFFile
initRead_()BALL::CIFFileprotectedvirtual
inSafeframe(const char *name)BALL::CIFFile
insertDatablock(const Datablock &datablock)BALL::CIFFile
INT_VALUE_NABALL::NMRStarFilestatic
is_open_BALL::Fileprotected
is_temporary_BALL::Fileprotected
isAccessible(String name)BALL::Filestatic
isAccessible() const BALL::File
isCanonized() const BALL::File
isClosed() const BALL::File
isExecutable(String name)BALL::Filestatic
isExecutable() const BALL::File
isMonomericPolymer(String chemical_unit_label)BALL::NMRStarFile
isOpen() const BALL::File
isReadable(String name)BALL::Filestatic
isReadable() const BALL::File
isTransformationEnabled(Transformation transformation)BALL::Filestatic
isValid() const BALL::File
isWritable(String name)BALL::Filestatic
isWritable() const BALL::File
MODE_APPBALL::Filestatic
MODE_ATEBALL::Filestatic
MODE_BINARYBALL::Filestatic
MODE_INBALL::Filestatic
MODE_OUTBALL::Filestatic
MODE_TRUNCBALL::Filestatic
molecule_BALL::CIFFileprotected
move(const String &source_name, const String &destination_name)BALL::Filestatic
moveTo(const String &destination_name)BALL::File
name_BALL::Fileprotected
NMRStarFile()BALL::NMRStarFile
NMRStarFile(const String &file_name, File::OpenMode open_mode=std::ios::in)BALL::NMRStarFile
open(const String &name, File::OpenMode open_mode=std::ios::in)BALL::File
open_mode_BALL::Fileprotected
OpenMode typedefBALL::File
operator!=(const NMRStarFile &f) const BALL::NMRStarFile
BALL::CIFFile::operator!=(const File &file) const BALL::File
operator==(const NMRStarFile &f) const BALL::NMRStarFile
BALL::CIFFile::operator==(const File &file) const BALL::File
original_name_BALL::Fileprotected
POSITION_VALUE_NABALL::NMRStarFilestatic
read()BALL::NMRStarFilevirtual
read(AtomContainer &ac)BALL::NMRStarFile
registerTransformation(const String &pattern, const String &exec)BALL::Filestatic
remove(String name)BALL::Filestatic
remove()BALL::File
rename(String old_path, String new_path)BALL::Filestatic
renameTo(const String &new_path)BALL::File
reopen()BALL::File
reopen(File::OpenMode open_mode)BALL::File
setMolecule(Molecule *molecule)BALL::CIFFile
setName(const String &name)BALL::File
stateBALL::CIFFilestatic
Transformation enum nameBALL::File
TRANSFORMATION__EXEC enum valueBALL::File
TRANSFORMATION__FILTER enum valueBALL::File
TRANSFORMATION__URL enum valueBALL::File
TRANSFORMATION_EXEC_PREFIXBALL::Filestatic
TRANSFORMATION_FILE_PREFIXBALL::Filestatic
TRANSFORMATION_FTP_PREFIXBALL::Filestatic
TRANSFORMATION_HTTP_PREFIXBALL::Filestatic
transformation_manager_BALL::Fileprotectedstatic
transformation_methods_BALL::Fileprotectedstatic
truncate(String path, Size size=0)BALL::Filestatic
truncate(Size size=0)BALL::File
Type enum nameBALL::File
TYPE__BLOCK_SPECIAL_FILE enum valueBALL::File
TYPE__CHAR_SPECIAL_FILE enum valueBALL::File
TYPE__DIRECTORY enum valueBALL::File
TYPE__FIFO_SPECIAL_FILE enum valueBALL::File
TYPE__REGULAR_FILE enum valueBALL::File
TYPE__SOCKET enum valueBALL::File
TYPE__SYMBOLIC_LINK enum valueBALL::File
TYPE__UNKNOWN enum valueBALL::File
unregisterTransformation(const String &pattern)BALL::Filestatic
write()BALL::CIFFilevirtual
~CIFFile()BALL::CIFFilevirtual
~File()BALL::Filevirtual
~NMRStarFile()BALL::NMRStarFile