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RDKit
Open-source cheminformatics and machine learning.
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#include <QueryOps.h>
Public Member Functions | |
HasPropWithValueQuery () | |
HasPropWithValueQuery (std::string prop, std::string v, const double=0.0) | |
PairHolder | getPair () const override |
double | getTolerance () const override |
bool | Match (const TargetPtr what) const override |
returns whether or not we match the argument | |
Queries::Query< int, TargetPtr, true > * | copy () const override |
returns a copy of this query | |
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HasPropWithValueQueryBase ()=default | |
virtual | ~HasPropWithValueQueryBase ()=default |
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EqualityQuery () | |
EqualityQuery (int v) | |
constructs with our target value | |
EqualityQuery (int v, int t) | |
constructs with our target value and a tolerance | |
void | setVal (int what) |
sets our target value | |
const int | getVal () const |
returns our target value | |
void | setTol (int what) |
sets our tolerance | |
const int | getTol () const |
returns out tolerance | |
std::string | getFullDescription () const override |
returns a fuller text description | |
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Query () | |
virtual | ~Query () |
void | setNegation (bool what) |
sets whether or not we are negated | |
bool | getNegation () const |
returns whether or not we are negated | |
void | setDescription (const std::string &descr) |
sets our text description | |
void | setDescription (const char *descr) |
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts. | |
const std::string & | getDescription () const |
returns our text description | |
void | setTypeLabel (const std::string &typ) |
sets our type label | |
void | setTypeLabel (const char *typ) |
This is an overloaded member function, provided for convenience. It differs from the above function only in what argument(s) it accepts. | |
const std::string & | getTypeLabel () const |
returns our text label. | |
void | setMatchFunc (bool(*what)(int)) |
sets our match function | |
void | setDataFunc (int(*what)(TargetPtr)) |
sets our data function | |
void | addChild (CHILD_TYPE child) |
adds a child to our list of children | |
CHILD_VECT_CI | beginChildren () const |
returns an iterator for the beginning of our child vector | |
CHILD_VECT_CI | endChildren () const |
returns an iterator for the end of our child vector | |
Additional Inherited Members | ||
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using | CHILD_TYPE | |
using | CHILD_VECT | |
using | CHILD_VECT_I | |
using | CHILD_VECT_CI | |
using | MATCH_FUNC_ARG_TYPE | |
using | DATA_FUNC_ARG_TYPE | |
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bool(*)(int) | getMatchFunc () const | |
returns our match function: | ||
int(*)(TargetPtr) | getDataFunc () const | |
returns our data function: | ||
int(* | d_dataFunc )(TargetPtr) | |
int(* | d_dataFuncSameType )(int) | |
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int | TypeConvert (int what, Int2Type< false >) const | |
calls our dataFunc (if it's set) on what and returns the result, otherwise returns what | ||
int | TypeConvert (TargetPtr what, Int2Type< true >) const | |
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int | d_val | |
int | d_tol | |
std::string | d_description | |
std::string | d_queryType | |
CHILD_VECT | d_children | |
bool | df_negate | |
bool(* | d_matchFunc )(int) | |
union { | ||
MatchFuncArgType(* d_dataFunc )(DataFuncArgType) | ||
MatchFuncArgType(* d_dataFuncSameType )(MatchFuncArgType) | ||
}; | ||
Definition at line 948 of file QueryOps.h.
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inline |
Definition at line 955 of file QueryOps.h.
References Queries::Query< int, TargetPtr, needsConversion >::setDataFunc(), and Queries::Query< int, TargetPtr, needsConversion >::setDescription().
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inlineexplicit |
Definition at line 961 of file QueryOps.h.
References Queries::Query< int, TargetPtr, needsConversion >::setDataFunc(), and Queries::Query< int, TargetPtr, needsConversion >::setDescription().
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inlineoverridevirtual |
returns a copy of this query
Reimplemented from Queries::EqualityQuery< int, TargetPtr, true >.
Definition at line 1008 of file QueryOps.h.
References Queries::Query< MatchFuncArgType, DataFuncArgType, needsConversion >::d_description, Queries::Query< int, TargetPtr, needsConversion >::d_description, Queries::Query< int, TargetPtr, needsConversion >::getNegation(), and Queries::Query< MatchFuncArgType, DataFuncArgType, needsConversion >::setNegation().
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inlineoverridevirtual |
Implements RDKit::HasPropWithValueQueryBase.
Definition at line 971 of file QueryOps.h.
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inlineoverridevirtual |
Implements RDKit::HasPropWithValueQueryBase.
Definition at line 973 of file QueryOps.h.
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inlineoverridevirtual |
returns whether or not we match the argument
Reimplemented from Queries::EqualityQuery< int, TargetPtr, true >.
Definition at line 975 of file QueryOps.h.
References Queries::Query< int, TargetPtr, needsConversion >::getNegation().