[gmx-users] Re: please help me

Mark Abraham Mark.Abraham at anu.edu.au
Fri Apr 6 06:33:42 CEST 2007


job560 at sohu.com wrote:
> Dear Mark:
> 
> thanks for your help.
> 
> My topology file "trp.top" have included "ions.itp" and I think  its
> 
> contents
> match the topology file as far as atom and molecule names.what's

It also needs to match the force field files you're using.

> more,"trp.top" and "ions.itp"
> in the same directory
> 
> I learn these commands just following a PDF file.
> 
> Now I  send to you these files  I've used,please help me!

I'm not a free help service. Please keep requests on the mailing list.

Mark



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