P.R.Anand Narayanan wrote:
hey there,
Can anyone of you pls help me rectify this error:
Warning: 1-4 interaction between 903 and 912 at distance 374.354 which
is larger than the 1-4 table size 1.000 nm
These are ignored for the rest of the simulation
This usually means your system is exploding,
if not, you should increase table-extension in your mdp file
See here:
http://oldwiki.gromacs.org/index.php/blowing_up
-Justin
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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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