[gmx-users] Non-biomolecular systems on Gromacs: incorporating a force field
marin at physics.unr.edu
Sat Oct 14 06:38:50 CEST 2006
I have couple of newbie questions that I hope someone will have
patience to answer. I have some experience with MD
simulation and none with Gromacs.
I have been using Tinker package for about half a year, but I
find it a little unfriendly (not a very thorough manual and it's
written in Fortran which is not my cup of tea :))
I see that most of tutorials and explanations on Gromacs site are
related to proteins. Is there a reason Gromacs would not be a
good choice for other systems, such as silica, for example?
I would like to incorporate force field for silica in the
Gromacs. Now where do I start? What source files would I need to
modify? It's OK if you can't give me a detailed answer, but at least
a starting point, a little bit more then that flow chart on the
Thanks for your help.
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