#include <BALL/KERNEL/standardPredicates.h>
Classes | |
class | CTPNode |
Public Member Functions | |
ConnectedToPredicate () | |
ConnectedToPredicate (const ConnectedToPredicate &predicate) | |
virtual | ~ConnectedToPredicate () |
virtual void | clear () |
virtual bool | operator() (const Atom &atom) const |
void | dump () const |
void | dump (const CTPNode *current) const |
virtual void | setArgument (const String &argument) |
Private Member Functions | |
CTPNode * | createNewNode_ (CTPNode *node) |
CTPNode * | parse_ () |
void | cleanUpNodes_ (std::vector< CTPNode * > &all_nodes) |
CTPNode * | parse_ (const String &input) |
bool | bondOrderMatch_ (const Bond &bond, const CTPNode &node) const |
bool | find_ (const Atom &atom, const CTPNode *current, HashSet< const Bond * > &visited) const |
Private Attributes | |
CTPNode * | tree_ |
HashMap< char, std::pair < CTPNode *, CTPNode * > > | link_map_ |
char | link_mark_ |
Predicate class for atoms being connected to a constellation defined by an expression. Syntax: {tabular}{cl} Bonds
-
& single =
& double
#
& triple
{126
} & aromatic
.
& any
Elements &
symbol
& the desired element *
& any element
Groups &
( )
& symbols enlosed by brackets denote groups {tabular}
Definition at line 480 of file standardPredicates.h.
BALL::ConnectedToPredicate::ConnectedToPredicate | ( | ) |
BALL::ConnectedToPredicate::ConnectedToPredicate | ( | const ConnectedToPredicate & | predicate | ) |
virtual BALL::ConnectedToPredicate::~ConnectedToPredicate | ( | ) | [virtual] |
bool BALL::ConnectedToPredicate::bondOrderMatch_ | ( | const Bond & | bond, | |
const CTPNode & | node | |||
) | const [private] |
void BALL::ConnectedToPredicate::cleanUpNodes_ | ( | std::vector< CTPNode * > & | all_nodes | ) | [private] |
virtual void BALL::ConnectedToPredicate::clear | ( | ) | [virtual] |
Clear method
Reimplemented from BALL::ExpressionPredicate.
void BALL::ConnectedToPredicate::dump | ( | const CTPNode * | current | ) | const |
void BALL::ConnectedToPredicate::dump | ( | ) | const |
bool BALL::ConnectedToPredicate::find_ | ( | const Atom & | atom, | |
const CTPNode * | current, | |||
HashSet< const Bond * > & | visited | |||
) | const [private] |
Evaluate the predicate for the atom atom
.
atom | the atom to test |
Reimplemented from BALL::ExpressionPredicate.
CTPNode* BALL::ConnectedToPredicate::parse_ | ( | ) | [private] |
virtual void BALL::ConnectedToPredicate::setArgument | ( | const String & | argument | ) | [virtual] |
set the Argument of this ExpressionPredicate
argument | the string to use for this predicate |
Reimplemented from BALL::ExpressionPredicate.
HashMap<char, std::pair<CTPNode*, CTPNode*> > BALL::ConnectedToPredicate::link_map_ [private] |
Definition at line 699 of file standardPredicates.h.
char BALL::ConnectedToPredicate::link_mark_ [private] |
Definition at line 703 of file standardPredicates.h.
CTPNode* BALL::ConnectedToPredicate::tree_ [private] |
Definition at line 695 of file standardPredicates.h.