[gmx-developers] Re: Electric force
David van der Spoel
spoel at xray.bmc.uu.se
Tue Jan 5 21:40:20 CET 2010
Aleksandr Morozenko wrote:
> Hello!
>
> Where is the routine where Gromacs calculates the electric force acting
> on an atom?
>
> Thanks in advance,
> Alex.
>
src/mdlib/sim_util.c
--
David van der Spoel, Ph.D., Professor of Biology
Molec. Biophys. group, Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone: +46184714205. Fax: +4618511755.
spoel at xray.bmc.uu.se spoel at gromacs.org http://folding.bmc.uu.se
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