[gmx-users] g_sorient with tip4p

[Kay Gottschalk]

Good idea, thanks!
K.

On Sunday, July 13, 2003, at 04:10 PM, David wrote:

> On Sun, 2003-07-13 at 14:53, Kay Gottschalk wrote:
>> Hi there,
>>
>> did anyone try to use g_sorient with tip4p? It complains that the
>> solvent has more than 3 atoms. One could try to convert the trajectory
>> to let's say gro format and 'manually' remove all the dummy atoms, but
>> perhaps there is a better way. Any ideas?
> You can do it with trjconv and an index file.
>
>
>> Thanks,
>> Kay.
>>
>> _______________________________________________
>> gmx-users mailing list
>> gmx-users at gromacs.org
>> http://www.gromacs.org/mailman/listinfo/gmx-users
>> Please don't post (un)subscribe requests to the list. Use the
>> www interface or send it to gmx-users-request at gromacs.org.
> --  
> Groeten, David.
> _______________________________________________________________________ 
> _
> Dr. David van der Spoel, 	Dept. of Cell and Molecular Biology
> 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://xray.bmc.uu.se/~spoel
> +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 
> +
> _______________________________________________
> gmx-users mailing list
> gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org.
>
>