[gmx-users] Simple L-J Particles' simulation for two type of atoms

[David]

On Tue, 2003-11-11 at 03:28, Albert Sun wrote:
> Dear David and Users,
>  
> I read chapter 5 a few times on .top file, but still can not solve my
> problem after added in another type of atom C into the .top file, The
> error messabe: "Moleculetype Argon contains no atoms". 
> my .top is as below :
> 
>    0.74158E-06 
> 
> [ moleculetype ]
> 
> ; molname nrexcl
> 
> Argon  1
> 
> Carbon 1
> 

you have two molecule names in one definition



-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assist. 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://xray.bmc.uu.se/~spoel
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