RDKit
Open-source cheminformatics and machine learning.
RDKit::MolStandardize::LargestFragmentChooser Class Reference

#include <Fragment.h>

Classes

struct  Largest
 

Public Member Functions

 LargestFragmentChooser (bool prefer_organic=false)
 
 LargestFragmentChooser (const LargestFragmentChooser &other)
 
 ~LargestFragmentChooser ()
 
ROMolchoose (const ROMol &mol)
 

Detailed Description

Definition at line 52 of file Fragment.h.

Constructor & Destructor Documentation

◆ LargestFragmentChooser() [1/2]

RDKit::MolStandardize::LargestFragmentChooser::LargestFragmentChooser ( bool  prefer_organic = false)
inline

Definition at line 55 of file Fragment.h.

◆ LargestFragmentChooser() [2/2]

RDKit::MolStandardize::LargestFragmentChooser::LargestFragmentChooser ( const LargestFragmentChooser other)

◆ ~LargestFragmentChooser()

RDKit::MolStandardize::LargestFragmentChooser::~LargestFragmentChooser ( )
inline

Definition at line 58 of file Fragment.h.

Member Function Documentation

◆ choose()

ROMol* RDKit::MolStandardize::LargestFragmentChooser::choose ( const ROMol mol)

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