[gmx-users] Constraints

[David van der Spoel]

On Wed, 2004-12-15 at 12:53 +0100, Uwe Richter wrote:
> Dear all,
> 
> is there a way to let parts of a protein move only a certain
> distance from the current position. I have a loop and I want
> to relax it by high temperature MD or simulated annealing but
> I don't want it to move too far away.
Use distance restraints (not these are not constraints)
> 
> Thanks for you help,
> Uwe
> 
> 
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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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