[gmx-users] Re: Dihedral Constraints

bharat gupta bharat.85.monu at gmail.com
Thu Jun 14 03:44:10 CEST 2012


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 ??


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