[gmx-users] REMD problem

Liu, Liang liu4gre at gmail.com
Wed Sep 28 22:32:36 CEST 2011


Well, although this makes sense, why all the 50 replicas are running when I
run "mpirun
       -np 50 mdrun_mpi -s md.tpr -multi 50 -replex 50" on my own computer
with only 2 cores?

By the way, would you please show me where I can find the reasonable replex
number information in the literature?  I did not find it in the link you
posted and the manual either.

Thanks.


-- 
Best,
Liang Liu
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110928/da7717fe/attachment.html>


More information about the gromacs.org_gmx-users mailing list