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Version 1.3.1
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23.2.2 OEWriteMDLFile 

void MyWriteMDLMolecule(oemolostream &ofs, OEMolBase &mol)
{
  OEClearAromaticFlags(mol);
  if (!OEMDLHasParity(mol))
    OEMDLPerceiveParity(mol);
  OEWriteMDLFile(ofs,mol);
  ofs << "$$$$" << endl;
}

Previous Page Up One Level Next Page OEChem - C++ Theory Manual
Version 1.3.1
Contents
Previous: 23.2.1 OEReadMDLFile Up: 23.2 MDL File Format Next: 23.3 Sybyl Mol2 File
Documentation released on July 30, 2004.