[gmx-users] use of distance dependent dielctric
David van der Spoel
spoel at xray.bmc.uu.se
Fri Jan 4 09:40:21 CET 2008
Ran Friedman wrote:
> It's not implemented AFAIK, but you can use a tabulated function for the
> Coulomb interactions.
That is correct. And what do you mean with distance dependent
dielectric? Divide by distance in Ångström?
Anyway this is easy to do in a table.
> Mark Abraham wrote:
>> kinshuk at chem.iitb.ac.in wrote:
>>> Hi all,
>>> i want to confirm whethere there is a distance dependent dielctric
>>> function in GROMACS.I want to use this. Please suggest me the possible
>> You should start by looking in the manual. My guess is that it is not
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David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
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
spoel at xray.bmc.uu.se spoel at gromacs.org http://folding.bmc.uu.se
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