[gmx-users] simulation popc
mahbubeh zarrabi
zarrab_m at yahoo.com
Mon May 28 13:56:23 CEST 2007
dear freind
thanks for helping. there is another errore: no such
moleculetype protein.
best wishes
--- Yang Ye <leafyoung at yahoo.com> wrote:
> Put two semicolon before
>
> ;[ defaults ]
> ;1 1
>
> in the lipid.itp
>
> ----- Original Message ----
> From: mahbubeh zarrabi <zarrab_m at yahoo.com>
> To: gmx-users at gromacs.org
> Sent: Monday, May 28, 2007 4:41:19 PM
> Subject: [gmx-users] simulation popc
>
>
> Dear all
> I want to simulate protein in popc.I dowanload
> popc128a.pdb from tieleman site and insert protein
> in
> popc by VMD BUT I can not run grompp.there is
> errore:
> found a second defaults directive file ffgmx.itp
> line6.whould you please help me?which protocole is
> useful for me(in detail)?
> best regard
>
>
>
>
>
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