Hello everyone,
in the past months I wrote a program to calculate chemical compound
characteristics (yet another ;) with a focus on scattering length
densities for scattering experiments in molecular material science.
Unfortunately, I couldn't use the code from gchemutils because I planned
to write the GUI with Qt (to simplify going cross-platform) and I didn't
want to introduce additional dependencies (especially because parsing
syntax only is a rather encapsulated/standalone task).
To solve this problem, I put this task into a separate library (inspired
by the modularization of gchemutils) which is supposed to be free of
additional dependencies.
Hence, here it is, maybe it's also of interest for you:
https://developer.berlios.de/projects/libcfp/
That's the final program:
https://developer.berlios.de/projects/qsldcalc/
Any opinions, comments and hints for improvements are always welcome ;)
Keep up the good work and
merry christmas,
Ingo.
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