[gmx-users] Re: Dihedral Constraints

Justin A. Lemkul jalemkul at vt.edu
Thu Jun 14 03:48:59 CEST 2012

On 6/13/12 9:44 PM, bharat gupta wrote:
> Hi,
> I wanted to simulate a beta-hairpin but with the dihedral angle of the turn
> residues constrained as per my wish for eg phi angle should not 60 and psi
> should be 90. Can anybody tell me how can I do this ??




Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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