_vdata | OBBase | [protected] |
AddAgent(const shared_ptr< OBMol > sp) | OBReaction | [inline] |
AddProduct(const shared_ptr< OBMol > sp) | OBReaction | [inline] |
AddReactant(const shared_ptr< OBMol > sp) | OBReaction | [inline] |
BeginData() | OBBase | [inline] |
CastAndClear(bool clear=true) | OBBase | [inline] |
ClassDescription() | OBReaction | [inline, static] |
Clear() | OBReaction | [inline, virtual] |
CloneData(OBGenericData *d) | OBBase | |
DataSize() const | OBBase | [inline] |
DeleteData(unsigned int type) | OBBase | |
DeleteData(OBGenericData *) | OBBase | |
DeleteData(std::vector< OBGenericData * > &) | OBBase | |
DeleteData(const std::string &s) | OBBase | |
DoTransformations(const std::map< std::string, std::string > *, OBConversion *) | OBBase | [inline, virtual] |
EndData() | OBBase | [inline] |
GetAgent() const | OBReaction | [inline] |
GetAllData(const unsigned int type) | OBBase | |
GetComment() const | OBReaction | [inline] |
GetData(const unsigned int type) | OBBase | |
GetData(const std::string &) | OBBase | |
GetData(const char *) | OBBase | |
GetData() | OBBase | [inline] |
GetData(DataOrigin source) | OBBase | |
GetProduct(const unsigned i) | OBReaction | [inline] |
GetReactant(const unsigned i) | OBReaction | [inline] |
GetTitle() const | OBReaction | [inline] |
OpenBabel::OBBase::GetTitle(bool replaceNewlines=true) const | OBBase | [inline, virtual] |
GetTransitionState() const | OBReaction | [inline] |
HasData(const std::string &) | OBBase | |
HasData(const char *) | OBBase | |
HasData(const unsigned int type) | OBBase | |
IsReversible() const | OBReaction | [inline] |
NumProducts() const | OBReaction | [inline] |
NumReactants() const | OBReaction | [inline] |
OBReaction() | OBReaction | [inline] |
SetComment(const std::string &comment) | OBReaction | [inline] |
SetData(OBGenericData *d) | OBBase | [inline] |
SetReversible(bool b=true) | OBReaction | [inline] |
SetTitle(const std::string &title) | OBReaction | [inline] |
OpenBabel::OBBase::SetTitle(const char *) | OBBase | [inline, virtual] |
SetTransitionState(const shared_ptr< OBMol > sp) | OBReaction | [inline] |
~OBBase() | OBBase | [inline, virtual] |