[gmx-users] How to add new residue(LIG reisdue)?

[Justin Lemkul]

On 8/5/12 4:46 PM, Ali Alizadeh wrote:
> Dear all users
>
> In my pdb file that contain ethane or propane or other molecules,
> there are LIG residue in my pdb file that gromacs could not found
> them, how to add this LIG(in our pdb files)  for my force field?
> This residue(LIG) exists in all pdb files for each simple molecules,
>

http://www.gromacs.org/Documentation/How-tos/Adding_a_Residue_to_a_Force_Field

-Justin

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

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