RDKit::MolStandardize::LargestFragmentChooser Class Reference

#include <Fragment.h>

Classes
struct	Largest

Public Member Functions
	LargestFragmentChooser (bool preferOrganic=false)
	LargestFragmentChooser (const CleanupParameters &params)
	LargestFragmentChooser (const LargestFragmentChooser &other)
	~LargestFragmentChooser ()=default
ROMol *	choose (const ROMol &mol) const
void	chooseInPlace (RWMol &mol) const

Detailed Description

Definition at line 74 of file Fragment.h.

Constructor & Destructor Documentation

LargestFragmentChooser() [1/3]

RDKit::MolStandardize::LargestFragmentChooser::LargestFragmentChooser ( bool preferOrganic = false )

inline

Definition at line 77 of file Fragment.h.

LargestFragmentChooser() [2/3]

RDKit::MolStandardize::LargestFragmentChooser::LargestFragmentChooser ( const CleanupParameters & params )

inline

Definition at line 79 of file Fragment.h.

LargestFragmentChooser() [3/3]

RDKit::MolStandardize::LargestFragmentChooser::LargestFragmentChooser

(

const LargestFragmentChooser &

other

)

~LargestFragmentChooser()

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

default

Member Function Documentation

choose()

ROMol * RDKit::MolStandardize::LargestFragmentChooser::choose

(

const ROMol &

mol

)

const

chooseInPlace()

void RDKit::MolStandardize::LargestFragmentChooser::chooseInPlace

(

RWMol &

mol

)

const

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

• Fragment.h