RDKit
Open-source cheminformatics and machine learning.
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RDKit::CIPLabeler::Priority Class Reference

#include <Priority.h>

Public Member Functions

 Priority ()=delete
 
 Priority (bool unique, bool pseudoAsym)
 
bool isUnique () const
 
bool isPseudoAsymetric () const
 

Detailed Description

Holds some properties that are determined when sorting/prioritising substituents.

Definition at line 21 of file Priority.h.

Constructor & Destructor Documentation

◆ Priority() [1/2]

RDKit::CIPLabeler::Priority::Priority ( )
delete

◆ Priority() [2/2]

RDKit::CIPLabeler::Priority::Priority ( bool unique,
bool pseudoAsym )
inline

Definition at line 25 of file Priority.h.

Member Function Documentation

◆ isPseudoAsymetric()

bool RDKit::CIPLabeler::Priority::isPseudoAsymetric ( ) const
inline

Indicates the descriptor type used to. This allows methods that represent pseudo-asymmetric molecules to indicate that the centre is pseudo-asymmetric.

Returns
The type of the descriptor that should be assigned

Definition at line 42 of file Priority.h.

◆ isUnique()

bool RDKit::CIPLabeler::Priority::isUnique ( ) const
inline

Indicates whether the substituents were unique (i.e. could be ordered)

Returns
whether the substituents were unique

Definition at line 33 of file Priority.h.


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