RDKit
Open-source cheminformatics and machine learning.
SLNParse.h File Reference
#include <RDGeneral/export.h>
#include <string>
#include <exception>

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Classes

class  RDKit::SLNParseException
 

Namespaces

 RDKit
 Std stuff.
 
 RDKit::SLNParse
 

Functions

RDKIT_SLNPARSE_EXPORT void RDKit::SLNParse::finalizeQueryMol (ROMol *mol, bool mergeHs)
 
void RDKit::SLNParse::CleanupAfterParse (RWMol *mol)
 
RDKIT_SLNPARSE_EXPORT RWMol * RDKit::SLNToMol (const std::string &smi, bool sanitize=true, int debugParse=0)
 
RDKIT_SLNPARSE_EXPORT RWMol * RDKit::SLNQueryToMol (const std::string &smi, bool mergeHs=true, int debugParse=0)