[gmx-users] Help regarding Force fields file
David van der Spoel
spoel at xray.bmc.uu.se
Thu Jan 27 08:59:28 CET 2005
On Thu, 2005-01-27 at 09:56 +0530, Atul Kumar wrote:
> Hi,
> i am a first time gromacs user.I am doing a project concerned with
> protein surface smoothening. For this i need to locate the force field
> files. Can anyone tell me the location of the force field file??
>
share/top/ffXXX*
where XXX is the force field and there are a number of files per force
field
> TIA
>
> atul
>
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--
David.
________________________________________________________________________
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://xray.bmc.uu.se/~spoel
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