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Version 1.3.1
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22.2.2 OEWriteMDLFile 

def MyWriteMDLMolecule(ofs, mol):
    OEClearAromaticFlags(mol)
    if not OEMDLHasParity(mol):
        OEMDLPerceiveParity(mol)
    OEWriteMDLFile(ofs, mol)
    ofs.write("$$$$\n")

Previous Page Up One Level Next Page OEChem - Python Theory Manual
Version 1.3.1
Contents Index
Previous: 22.2.1 OEReadMDLFile Up: 22.2 MDL File Format Next: 22.3 Sybyl Mol2 File
Documentation released on July 30, 2004.