[gmx-users] Shima Arasteh wants to share a link | Gromacs

Mark Abraham Mark.Abraham at anu.edu.au
Thu Mar 29 09:48:04 CEST 2012

On 29/03/2012 4:53 PM, rossen at kth.se wrote:
> Shima Arasteh wants to a share a link on the Gromacs wiki: http://www.gromacs.org/
> Shima Arasteh says:
> Dear Gromacs friends,
> I am a new user of Gromacs, following the kalp-15 in DPPC tutorial instruction but I face a fatal error when I enter this command:
> grompp -f minim.mdp -c dppc128.gro -p topol_dppc.top -o em.tpr
> And the fatal error is this:
> atomtype LC3 not found
> Anybody can suggest me a solution to solve my problem?

You've done something wrong, unless you're the first person to correctly 
follow a wrong tutorial :-) A [moleculetype] is referencing an 
[atomtype] that your force field has not defined. Go back and try again.


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