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RDKit
Open-source cheminformatics and machine learning.
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This is the complete list of members for RDKit::PDBWriter, including all inherited members.
close() | RDKit::PDBWriter | inlinevirtual |
flush() | RDKit::PDBWriter | inlinevirtual |
numMols() const | RDKit::PDBWriter | inlinevirtual |
PDBWriter(const std::string &fileName, unsigned int flavor=0) | RDKit::PDBWriter | |
PDBWriter(std::ostream *outStream, bool takeOwnership=false, unsigned int flavor=0) | RDKit::PDBWriter | |
setProps(const STR_VECT &) | RDKit::PDBWriter | inlinevirtual |
write(const ROMol &mol, int confId=defaultConfId) | RDKit::PDBWriter | virtual |
~MolWriter() | RDKit::MolWriter | inlinevirtual |
~PDBWriter() | RDKit::PDBWriter |