风 大 wrote:
Dear all,
I want to impose a homogeneous static magnetic field on a solution. I
just wonder if the gromacs can do it, anyway? I believe gromacs can.
However, could anyone give me some suggestions to do it?
This is not implemented. I assume you would want to add a Lorentz force?
The best way to add this code is in the subroutine that does the
electric field stuff (src/mdlib/sim_util.c, routine calc_f_el).
Thanks a lot!
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David.
________________________________________________________________________
David van der Spoel, PhD, Professor of Biology
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
[email protected] [email protected] http://folding.bmc.uu.se
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