[gmx-users] Re: Force field parameters in water or in vacuum?

Mark Abraham Mark.Abraham at anu.edu.au
Fri May 23 06:53:19 CEST 2008


Chih-Ying Lin wrote:
> Hi
> for  45a3 force field, is it created in vacuum / in water or solution ?
> Justin said the most of the force field is defined as condensed phase ???
> Do you mean the liquid phase / or in water phase ?

Check the GROMACS manual for literature references for this and other 
force fields. There's no substitute for having read them.

Mark



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