ms wrote:
Mark Abraham ha scritto:
ms wrote:
Hi,
As per the title. I need to understand what is the difference to help
myself debug my inane efforts at CG parametrization. LJ(1-4) I think is
clear (non bonded, non-coulombic interactions between 1-4 pairs
described in the topology), but about the rest?
See manual 4.6.3
Seen it, still don't get it :)
A good reason to search the mailing list...
http://lists.gromacs.org/pipermail/gmx-users/2007-December/031264.html
-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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