[gmx-users] Simulation at different temperature

[David van der Spoel]

s lal badshah wrote:
> Dear Experts,
> Hi ! I want to simulate a protein at 298K, 283K, and at 323k.For all  
> these temperature will I prepare different md.mdp files or single ?
different. check mdp options ref-t
> Regards,
> Lal badshah.
> 
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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://folding.bmc.uu.se
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