On 1/3/13 7:23 AM, Alexej Mazheika wrote:
Dear all!
I'm new with Gromacs.
I prepared some job for it but I cann't start with grompp. It writes me
"Fatal error:
Something is wrong in the coordinate formatting of file conf.gro. Note that
gro is fixed format (see the manual)".
What is wrong? I want to calculate a silver cluster contining 125 atoms.
And the conf.gro file was prepared according to on-line manual of Gromacs.
Corresponding input-files are attached here.
The mailing list does not accept attachments. Please cut and paste into the
message body.
-Justin
--
========================================
Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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