[gmx-users] Position restraint code , where ?

[chicago.ecnu]

Dear Gromacs Users,

    Harmonic potentials are used in Gromacs for imposing restraints on the motion of the system.
   
    V = 1/2 * k * (x-x0)^2
     
  And the forces are : F =  -k * (x-x0) . ...

   I want to use constant force for the restraint.  

  Just scale the force  : F = -k * (x-x0) / sqrt ( (x-x0)**2+(y-y0)**2 + (z-z0)**2 )  ...
 
  This was very simple.

  But I don't know where the position restraint code is . 

 Could you please tell me where I can start with ? 


 Many thanks for your help !



Best Wishes,


Yours Sincrely,
Chiango Ji





   

 
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110710/af0c9e47/attachment.html>