[gmx-users] spc model of water

Justin A. Lemkul jalemkul at vt.edu
Mon Aug 24 16:05:09 CEST 2009

abhijit kayal wrote:
> Hi,
>     Myself Abhijit Kayal.Please anyone can give me the right 
> topology,grompp and conf file of spc model of water.

The coordinate and topolgy file for SPC water is provided in the /share/top 
subdirectory of your Gromacs installation.  There is no standard grompp input 
file; you must choose the parameters for the system you are trying to simulate.


> Abhijit Kayal
>                                                                     IIT 
> Delhi
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Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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