[gmx-users] Re: One molculetype for 3 proteins

Steven Neumann s.neumann08 at gmail.com
Fri May 25 23:06:47 CEST 2012


Thanks Francesca. There is no bond between them. I merged topologies and
the grompp error comes from the gmx bug posted by Mark.
http://redmine.gromacs.org/issues/885
Thanks for this link Justin!

Steven

On Fri, May 25, 2012 at 5:47 PM, Francesca <francesca.stanzione at unina.it>wrote:

> if you create a bond you need to have angle, tortion etc...
> Maybe when you processed pb2gmx it create a bond between the 799 and 801.
> Francesca
>
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