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

ms devicerandom at gmail.com
Fri Dec 4 13:15:07 CET 2009


Justin A. Lemkul ha scritto:
>>>> 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


Uh, thanks! I always google the ML before asking, but my googling skills
are evidently not as good as I thought. Thanks!



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