jeremy adler wrote:
I am getting ab error with the newest version of the martini model in
which seq2itp, atom2cg generate structures with a topology mismatch if
there are any alanines in the structure 9. mutating out the alanines
seems to resolve the problem? are there any bug fixes out there?
You're better off contacting the MARTINI developers, since this is not actually
a Gromacs problem.
-Justin
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
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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