[gmx-users] Is there a way to use diffrent scaling factors for 1-4 interaction?

Xiaobing Feng xbfeng05 at yahoo.com.cn
Sat Nov 5 06:42:58 CET 2005

Dear gmx-users,

    I'm converting a force field from DLPOLY to GROMACS.
  There are two different 1-4 interactions, one has full 1-4 LJ and Coulomb 
   interaction, the one has scaling factor 0.0 and 0.617 for 1-4 LJ and Coulomb
   interaction, respectively.  Is there a way in GROMACS in which we can
    use different scaling factors for different 1-4 interactions?

     Many thanks,




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