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BALL::HybridisationProcessor Member List

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

argument_pointer typedef | BALL::UnaryFunctor< ArgumentType, ResultType > |
argument_reference typedef | BALL::UnaryFunctor< ArgumentType, ResultType > |
argument_type typedef | BALL::UnaryFunctor< ArgumentType, ResultType > |
atom_type_smarts_ | BALL::HybridisationProcessor | protected
AverageBondAngle_(Atom *a) | BALL::HybridisationProcessor | protected
BALL_CREATE(HybridisationProcessor) | BALL::HybridisationProcessor |
bond_angles_ | BALL::HybridisationProcessor | protected
const_argument_pointer typedef | BALL::UnaryFunctor< ArgumentType, ResultType > |
const_argument_reference typedef | BALL::UnaryFunctor< ArgumentType, ResultType > |
elements_ | BALL::HybridisationProcessor | protected
finish() | BALL::UnaryProcessor< AtomContainer > | inline virtual
getHybridisationMap() | BALL::HybridisationProcessor | inline
getNumberOfHybridisationStatesSet() | BALL::HybridisationProcessor |
HybridisationProcessor() | BALL::HybridisationProcessor |
HybridisationProcessor(const HybridisationProcessor &hp) | BALL::HybridisationProcessor |
HybridisationProcessor(const String &smarts_file_name, const String &ff_file_name) | BALL::HybridisationProcessor |
num_hybridisation_states_ | BALL::HybridisationProcessor | protected
operator()(AtomContainer &ac) | BALL::HybridisationProcessor | virtual
operator=(const HybridisationProcessor &hp) | BALL::HybridisationProcessor |
options | BALL::HybridisationProcessor |
readAndInitBondAnglesFromFile_(const String &file_name="") | BALL::HybridisationProcessor | protected
readAtomTypeSmartsFromFile_(const String &file_name="") | BALL::HybridisationProcessor | protected
result_type typedef | BALL::UnaryFunctor< ArgumentType, ResultType > |
setAtomTypeSmarts(const String &file_name) | BALL::HybridisationProcessor |
setDefaultOptions() | BALL::HybridisationProcessor |
start() | BALL::HybridisationProcessor | virtual
UnaryProcessor() | BALL::UnaryProcessor< AtomContainer > | inline
UnaryProcessor(const UnaryProcessor &) | BALL::UnaryProcessor< AtomContainer > | inline
valid_ | BALL::HybridisationProcessor | protected
~HybridisationProcessor() | BALL::HybridisationProcessor | virtual
~UnaryProcessor() | BALL::UnaryProcessor< AtomContainer > | inline virtual