From: Jérôme Hénin (jerome.henin_at_ibpc.fr)
Date: Tue Nov 23 2021 - 09:21:14 CST
Once you have defined a distanceXY variable (say it is named "d_xy"), you can use this restraint block:
Where <k> is the desired value of the force constant. Note that some keywords are plural because they can take a list of values if the restraint is acting on several colvars at the same time.
----- On 22 Nov 21, at 19:25, Ropón-Palacios <biodano.geo_at_gmail.com> wrote:
> Dear Users,
> I like applie to colvar distancexy an cylinder restraint, but not know as define
> right harmonicWall, please help me.
> My diameter for restraint is 50 (-25,25)
> Enviado desde mi iPhone
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