> Then I'm doubly confused as to why having that line changes the
> behaviour of the code beneath it. My guess was that, for whatever
> reason, OBConversion is not pulling in the charge models and that my
> botched line above is pulling in enough for
If you like, send me the code, and I'll take a
> I am trying to assign the Gasteiger partial charges to all the atoms.
> However, when I implemented the algorithm in molchrg.cpp (separate from
> OpenBabel), the sum of my partial charges is always 0 whereas the sum of
> OpenBabel partial charges is sometimes 0, -1, or 1.
Open Babel has "seed