On 3/25/13 2:47 PM, Shima Arasteh wrote:
Would you please let me know that what subject I need to look for through
manual or threads? Making index groups of multiple atoms?
What you need to understand is how the position restraint mechanism works. If
you know that, you can make .itp files by hand using a text editor if you like
(which is actually what I do in the case of one-liners like lipid_posre.itp for
what you're doing).
-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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