Hi, Many thanks for the prompt response, Cheers Chris
> On 12 Feb 2025, at 20:19, Geoffrey Hutchison <geoff.hutchi...@gmail.com> > wrote: > > I don’t think at the moment, we have something that copies any entries with > errors. It’s a useful idea. > > -Geoff > > On Feb 11, 2025 at 4:06:09 AM, Chris Swain via OpenBabel-discuss > <openbabel-discuss@lists.sourceforge.net > <mailto:openbabel-discuss@lists.sourceforge.net>> wrote: >> Hi, >> >> I want to convert some very large sdf files to SMILES. I know that some >> structures will fail to convert. >> >> Is it possible to do the conversion creating two files, one containing the >> valid SMILES and another file containing the records that failed to convert? >> Either as a sdf file or simply a text file containing the title of molecules. >> >> Cheers >> >> Chris >> >> _______________________________________________ >> OpenBabel-discuss mailing list >> OpenBabel-discuss@lists.sourceforge.net >> <mailto:OpenBabel-discuss@lists.sourceforge.net> >> https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
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