[gmx-users] Three molecules in single topol.top file

[Chang Woon Jang]

Dear Sako Mirzaie,

   Thank you for your response. Do you mean that there is no way to include
topologies in a single topol.top, and I need to separate them into three
pieces of itp files?

Best regards,
Changwoon Jang


On Wed, Aug 31, 2016 at 11:57 AM, SAKO MIRZAIE <sako.biochem at gmail.com>
wrote:

> because it is incorrect format. the topology can be produced by pdb2gmx
> automatically. for several molecules, you could include them as itp file
> format.
>
> On Wed, Aug 31, 2016 at 8:05 PM, Nikhil Maroli <scinikhil at gmail.com>
> wrote:
>
> > http://manual.gromacs.org/online/top.html
> >
> > And what is the error?
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> --
> ***********************************************
> Sako Mirzaie
> PhD in biochemistry, Assistant Professor, science faculty, Islamic Azad
> university of
> Sanandaj, Sanandaj, Iran
>
> http://www.iausdj.ac.ir/fa/fa-info.aspx?p=s.mirzaie
>
> http://www.iausdj.ac.ir/en/en.aspx?p=s.mirzaie
>
> http://scholar.google.com/citations?user=viwZvVAAAAAJ&hl=en
>
> http://www.scopus.com/authid/detail.url?authorId=54886431500
>
> http://www.ncbi.nlm.nih.gov/pubmed/?term=sako+mirzaie
> https://www.researchgate.net/profile/Sako_Mirzaie/publications/
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-- 
Best regards,
Changwoon Jang,

Postdoctoral Research Fellow
Department of Chemical & Biological Engineering, Drexel University
3141 Chestnut Street, Philadelphia, PA 19104

Voice: (662) 617-2267
E-mail: cj395 at drexel.edu