[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,
Xiaobing
___________________________________________________________
雅虎免费G邮箱-中国第一绝无垃圾邮件骚扰超大邮箱
http://cn.mail.yahoo.com
More information about the gromacs.org_gmx-users
mailing list