Thanks Geoff.
> On 15 Nov 2016, at 20:18, Geoffrey Hutchison <geoff.hutchi...@gmail.com> > wrote: > >> /usr/local/bin/obabel '/Users/Chris/Desktop/confs/temp1.sdf' -omop -xf >> '/Users/Chris/Desktop/confs/temp1.mop’ > > > The key problem is the use of the -xf flag. This is a way to set keywords in > the MOPAC file by reading another file. (Useful for batch processing): > > obabel *.sdf -omop -xf “keywords” -m # convert multiple files > > Hope that helps, > -Geoff ------------------------------------------------------------------------------ _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
