RDKit
Open-source cheminformatics and machine learning.
RDKit::FilterMatchOps::Not Class Reference

#include <FilterMatchers.h>

Inheritance diagram for RDKit::FilterMatchOps::Not:
RDKit::FilterMatcherBase

Public Member Functions

 Not ()
 
 Not (const FilterMatcherBase &arg1)
 
 Not (const boost::shared_ptr< FilterMatcherBase > &arg1)
 
 Not (const Not &rhs)
 
virtual std::string getName () const
 
bool isValid () const
 
bool hasMatch (const ROMol &mol) const
 hasMatches More...
 
bool getMatches (const ROMol &mol, std::vector< FilterMatch > &) const
 getMatches More...
 
boost::shared_ptr< FilterMatcherBasecopy () const
 copy More...
 
- Public Member Functions inherited from RDKit::FilterMatcherBase
 FilterMatcherBase (const std::string &name=DEFAULT_FILTERMATCHERBASE_NAME)
 
 FilterMatcherBase (const FilterMatcherBase &rhs)
 
virtual ~FilterMatcherBase ()
 
virtual boost::shared_ptr< FilterMatcherBaseClone () const
 Clone - deprecated. More...
 

Detailed Description

Definition at line 173 of file FilterMatchers.h.

Constructor & Destructor Documentation

RDKit::FilterMatchOps::Not::Not ( )
inline

Definition at line 178 of file FilterMatchers.h.

RDKit::FilterMatchOps::Not::Not ( const FilterMatcherBase arg1)
inline

Constructs a Noter true if arg1 is false (note, never returns matches

Definition at line 184 of file FilterMatchers.h.

RDKit::FilterMatchOps::Not::Not ( const boost::shared_ptr< FilterMatcherBase > &  arg1)
inline

Definition at line 187 of file FilterMatchers.h.

RDKit::FilterMatchOps::Not::Not ( const Not rhs)
inline

Definition at line 190 of file FilterMatchers.h.

Member Function Documentation

boost::shared_ptr<FilterMatcherBase> RDKit::FilterMatchOps::Not::copy ( ) const
inlinevirtual

copy

Implements RDKit::FilterMatcherBase.

Definition at line 211 of file FilterMatchers.h.

References RDUNUSED_PARAM, and RDKit::SMARTS_MATCH_NAME_DEFAULT.

bool RDKit::FilterMatchOps::Not::getMatches ( const ROMol mol,
std::vector< FilterMatch > &  matchVect 
) const
inlinevirtual

getMatches

Match the filter against a molecule

Parameters
molreadonly const molecule being searched
matchesoutput vector of atom index matches found in the molecule

Implements RDKit::FilterMatcherBase.

Definition at line 203 of file FilterMatchers.h.

References RDKit::FilterMatchOps::And::isValid(), and PRECONDITION.

virtual std::string RDKit::FilterMatchOps::Not::getName ( ) const
inlinevirtual

Reimplemented from RDKit::FilterMatcherBase.

Definition at line 192 of file FilterMatchers.h.

References RDKit::FilterMatcherBase::getName().

bool RDKit::FilterMatchOps::Not::hasMatch ( const ROMol mol) const
inlinevirtual

hasMatches

Does the given molecule contain this filter pattern

Parameters
molreadonly const molecule being searched

Implements RDKit::FilterMatcherBase.

Definition at line 198 of file FilterMatchers.h.

References RDKit::FilterMatchOps::And::isValid(), and PRECONDITION.

bool RDKit::FilterMatchOps::Not::isValid ( ) const
inlinevirtual

Implements RDKit::FilterMatcherBase.

Definition at line 196 of file FilterMatchers.h.


The documentation for this class was generated from the following file: