Mark Abraham wrote:
Limei Zhang wrote:
Hi, there,
I had a problem running mdrun on multiple processors and multiple
threads.
Thread support will not be available until GROMACS 4.0
Make that 5.0
But it will be a lot faster in 4.0 already.
Mark
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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
[EMAIL PROTECTED] [EMAIL PROTECTED] http://folding.bmc.uu.se
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