[gmx-developers] gromacs from git threads and md-vv

Alexey Shvetsov alexxyum at gmail.com
Wed Feb 3 19:39:23 CET 2010


	Hi all!
I compiled gromacs from git with threads enabled (instead of mpi).
while testing i get deadlock on speptide system while using md-vv integrator.
with almoust same parameters but with standart leapfrog (md) integrator same 
system works fine.

PS all compiled with debug so i can provide backtarces and all needed input 
files
-- 
Best Regards,
Alexey 'Alexxy' Shvetsov
Petersburg Nuclear Physics Institute, Russia
Department of Molecular and Radiation Biophysics
Gentoo Team Ru
Gentoo Linux Dev
mailto:alexxyum at gmail.com
mailto:alexxy at gentoo.org
mailto:alexxy at omrb.pnpi.spb.ru
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