[gmx-users] GROMACS Constraints

[Justin Lemkul]

On 3/21/13 3:05 PM, 256B wrote:
> Hello Everyone,
>
> I am running MD on a protein with a heme. I want to use gromacs to build a
> bond constraint btw a heme and a his. Does anyone know the proper syntax to
> do so ?
>

Consult Chapter 5 of the manual for all topology-related information.

-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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