Dongsheng Zhang wrote:
Dear gmx users,
I have trouble to run REMD on one node with two processors. The command
I used is
/home/brasilia/dong/mdrun_mpi -np 2 -replex 500 -reseed -1 -multi -s
replica -deffnm replica -N 2 -v >& zevel
the error message is:
Can not open file:
replica.tpr
you need replica0 and replica1.tpr
This error message looks strange to me. Because I have used -multi, the
program should look for replica0.tpr and replica1.tpr. Could anyone
point out what's wrong in my command?
Thank you in advance!
Dongsheng
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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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