[gmx-users] how to run NVT MD???

[David]

On Sat, 2005-09-03 at 11:10 +0530, Rahul Karyappa wrote:
> Dear GROMACS users,
>    I have doubt which I would like to ask you. I don't want to run NPT
> ensemble MD then how I can run NVT ensemble MD run? 
> If I put 'no' in front of Pcoupl (Pcoupl=no), will it be a NVT run?
yes.
> Please tell me about this. Thanking you in advance.
> Rahul Karyappa
> NCL, India
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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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