[gmx-users] reagarding polarisable force field in gromacs

sreelakshmi ramesh sree.lakshmi at research.iiit.ac.in
Mon Dec 20 04:58:22 CET 2010


Dear justin ,
                   I read the manual and i didnt get it thats why i sought
the help of people here.i want to know how to use those polarisable force
field.

On Mon, Dec 20, 2010 at 9:15 AM, Justin A. Lemkul <jalemkul at vt.edu> wrote:

>
>
> sreelakshmi ramesh wrote:
>
>> Dear all,
>>            can anyone tell me if there  are polarisable force field
>> available in gromacs.I need to use dang chang force field which is
>> polarisable force field for my work.I have used classical force fields
>> before can anyone help me out regaring this.
>>
>>
> Start by reading the manual.  All of the force fields included in Gromacs
> are described.  Polarizability is discussed in section 4.4, mostly in
> relation to water models.
>
> -Justin
>
>
>> thanks in advance ,
>> shree
>>
>>
> --
> ========================================
>
> 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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