Thamu wrote:
Hi,
when I run PR mdrun, i got the following warning message. the program
can not run further.
Step 481 Warning: Pressure scaling more than 1%.
Please refer to the wiki entry on this topic:
http://oldwiki.gromacs.org/index.php/Errors#Pressure_scaling_more_than_1.25
Beyond that, you'll have to post a more complete description of your system,
including the .mdp file you're using, to get any more useful advice.
-Justin
I would greatly appreciate gromacs users suggestions.
Thanking you,
Yours sincerely,
Thamotharan
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--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
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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