[gmx-users] 1-4 interaction parameters in GROMOS 54a7

[Catarina A. Carvalheda dos Santos]

Hi Faust,

Check the following references:
- Schmid_2011_EBJ
<http://link.springer.com/article/10.1007%2Fs00249-011-0700-9>
- Oostenbrink_2004_JCC
<http://onlinelibrary.wiley.com/doi/10.1002/jcc.20090/abstract;jsessionid=DD303C7931D12ADBADAD744E9CB2EE6D.f04t01>

Hope this helps.

Cheers,


On 27 September 2016 at 21:58, Faust SHI <shi86 at wisc.edu> wrote:

> Hi all,
>
> Does anyone know how to generate the 1-4 interaction parameters (c6 and
> c12) in gromos 54a7 FF? Is there any reference about that?
> Thanks!
>
> Yours sincerely,
> Faust
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-- 
Catarina A. Carvalheda

PhD Student
Computational Biology Division
SLS & SSE
University of Dundee
DD1 5EH, Dundee, Scotland, UK