[gmx-users] Re: Something about getting started

[Justin A. Lemkul]

DreamCatcher wrote:
> 
> Dear Justin,
>         I did make the rtp and hdb files in accordance with the tutorial 
> onthe website 
> <http://oldwww.gromacs.org/pipermail/gmx-users/2009-March/040125.html>http://oldwww.gromacs.org/pipermail/gmx-users/2009-March/040125.html 
> <http://oldwww.gromacs.org/pipermail/gmx-users/2009-March/040125.html,but>,but 
> the problem cann't be settle,what can I do?

The [atoms] sections you presented are incorrect.  They lack both charge and 
charge group information.

>        Looking forward for your reply!
>        Thanks,
>                                                                                                                        
> dreamcatcher

Please take note of the following:

>     When replying, please edit your Subject line so it is more specific
>     than "Re: Contents of gmx-users digest..."

-Justin

-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

========================================