RDKit::MolOps::AdjustQueryParameters Struct Reference

#include <MolOps.h>

Public Member Functions
	AdjustQueryParameters ()

Public Attributes
bool	adjustDegree
AdjustQueryWhichFlags	adjustDegreeFlags
bool	adjustRingCount
AdjustQueryWhichFlags	adjustRingCountFlags
bool	makeDummiesQueries

Detailed Description

Definition at line 250 of file MolOps.h.

Constructor & Destructor Documentation

AdjustQueryParameters()

RDKit::MolOps::AdjustQueryParameters::AdjustQueryParameters ( )

inline

Definition at line 259 of file MolOps.h.

References RDKit::MolOps::adjustQueryProperties(), and RDKit::MolOps::renumberAtoms().

Member Data Documentation

adjustDegree

bool RDKit::MolOps::AdjustQueryParameters::adjustDegree

add degree queries

Definition at line 251 of file MolOps.h.

adjustDegreeFlags

AdjustQueryWhichFlags RDKit::MolOps::AdjustQueryParameters::adjustDegreeFlags

Definition at line 252 of file MolOps.h.

adjustRingCount

bool RDKit::MolOps::AdjustQueryParameters::adjustRingCount

add ring-count queries

Definition at line 253 of file MolOps.h.

adjustRingCountFlags

AdjustQueryWhichFlags RDKit::MolOps::AdjustQueryParameters::adjustRingCountFlags

Definition at line 254 of file MolOps.h.

makeDummiesQueries

bool RDKit::MolOps::AdjustQueryParameters::makeDummiesQueries

convert dummy atoms without isotope labels to any-atom queries

Definition at line 256 of file MolOps.h.

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

• MolOps.h