[gmx-users] What is the exact difference in the g_energy output between LJ(1-4) LJ(SR) and LJ(LR)?

[Justin A. Lemkul]

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

-- 
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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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