[gmx-users] Force field for unstructured protein

ms devicerandom at gmail.com
Tue Oct 21 12:32:16 CEST 2014


On 10/21/14 12:28 PM, Netaly Khazanov wrote:
> Dear Gromacs Users,
> I want to study folding of isolated unstructured domain of the protein.
> Do you have any recommendations which Force Field could possibly be used
> for this purpose?
> Thank you in advance.
> Netaly Khazanov.
>
You can start from this comparison of force fields against experimental 
data:
http://www.plosone.org/article/info%3Adoi%2F10.1371%2Fjournal.pone.0032131

Massimo


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