RDKit
Open-source cheminformatics and machine learning.
RDKit::SmilesWriter Member List

This is the complete list of members for RDKit::SmilesWriter, including all inherited members.

close()RDKit::SmilesWriterinlinevirtual
flush()RDKit::SmilesWriterinlinevirtual
numMols() constRDKit::SmilesWriterinlinevirtual
setProps(const STR_VECT &propNames)RDKit::SmilesWritervirtual
SmilesWriter(const std::string &fileName, const std::string &delimiter=" ", const std::string &nameHeader="Name", bool includeHeader=true, bool isomericSmiles=true, bool kekuleSmiles=false)RDKit::SmilesWriter
SmilesWriter(std::ostream *outStream, std::string delimiter=" ", std::string nameHeader="Name", bool includeHeader=true, bool takeOwnership=false, bool isomericSmiles=true, bool kekuleSmiles=false)RDKit::SmilesWriter
write(const ROMol &mol, int confId=defaultConfId)RDKit::SmilesWritervirtual
~MolWriter()RDKit::MolWriterinlinevirtual
~SmilesWriter()RDKit::SmilesWriter