RDKit::MolStandardize::DisallowedAtomsValidation Class Reference

#include <Validate.h>

Inheritance diagram for RDKit::MolStandardize::DisallowedAtomsValidation:

Public Member Functions
	DisallowedAtomsValidation (std::vector< std::shared_ptr< Atom > > atoms)
std::vector< ValidationErrorInfo >	validate (const ROMol &mol, bool reportAllFailures) const override
std::shared_ptr< ValidationMethod >	copy () const override
Public Member Functions inherited from RDKit::MolStandardize::ValidationMethod
	ValidationMethod ()=default
virtual	~ValidationMethod ()=default

Detailed Description

The DisallowedAtomsValidation class lets the user input a list of atoms and as long as there are no atoms from the list it is deemed acceptable.

Definition at line 178 of file Validate.h.

Constructor & Destructor Documentation

DisallowedAtomsValidation()

RDKit::MolStandardize::DisallowedAtomsValidation::DisallowedAtomsValidation ( std::vector< std::shared_ptr< Atom > > atoms )

inline

Definition at line 181 of file Validate.h.

Member Function Documentation

copy()

std::shared_ptr< ValidationMethod > RDKit::MolStandardize::DisallowedAtomsValidation::copy ( ) const

inlineoverridevirtual

Implements RDKit::MolStandardize::ValidationMethod.

Definition at line 186 of file Validate.h.

validate()

std::vector< ValidationErrorInfo > RDKit::MolStandardize::DisallowedAtomsValidation::validate ( const ROMol & mol, bool reportAllFailures ) const

overridevirtual

Implements RDKit::MolStandardize::ValidationMethod.

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

• Validate.h