[gmx-users] Minimization problem
jalemkul at vt.edu
Thu Jan 17 16:50:36 CET 2013
On 1/17/13 9:54 AM, Marcelo Depolo wrote:
> Well, Justin,
> I tried to generate the .tpr using single precision and I got the same
> warning. I also tried to use gmxcheck using the command line below:
> *$ gmxcheck -e prt_cg.edr -m cg.tex*
> Unfortunately, I got the same warning and no log file. What is a I/O issue?
You won't get a log file. The -m flag is used only to print methods information
from the .tpr file and is not relevant here. An I/O issue is an input/output
problem (i.e. reading/writing from/to the disk). If it happens every time you
run the minimization, that doesn't sound like it's relevant.
Is this reproducible with 4.6beta3?
Justin A. Lemkul, Ph.D.
Department of Biochemistry
jalemkul[at]vt.edu | (540) 231-9080
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