[gmx-users] about gromacs

[David van der Spoel]

代振宇 wrote:
> Hello, everyone:
> 
>     Would you please tell me that whether Gromacs can be used to do Molecular Dynamics studies for Polymer like PVC or PET? Thanks a lot.
> 

yes if you provide the input files. gromacs does not have many tools to 
deal with preparing input files for such systems, but have a look at genbox.

>     dai0601
> 
>     2006-09-07
> 
>     
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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