shahrbanoo karbalaee wrote:
Dear justin
hi,
I minimized my peptides with gromacs 3,3,3 .Can I use this files
(em.gro) for pr and md with gromacs 3,3,1.?
Maybe, but it always best to keep consistent with the same version of Gromacs.
Version 3.3.3 introduces some bug fixes over 3.3.1, at the very least. Not to
mention the questions reviewers might raise about your work if you did different
parts of your simulations in different versions - you are inviting criticism.
-Justin
best
--
========================================
Justin A. Lemkul
Graduate Research Assistant
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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