The program system MOLGEN is devoted to the computation of all structural formulae (=connectivity isomers) that correspond to a given molecular formula, with (optional) further conditions (e.g. substructures). MOLGEN arose from the idea to provide an efficient and portable tool for molecular structure elucidation in both chemical industry, research and education.
Citation:
@article{molgen,
author="Grund, R. and Kerber, A. and Laue, R.",
title="{MOLGEN, ein Computeralgebra-System für die Konstruktion molekularer Graphen. (MOLGEN - a c\
omputer algebra system for the construction of molecular graphs).}",
language="German",
journal="Match",
volume="27",
pages="87-131",
year={1992}
}