AMBER Archive (2009)

Subject: [AMBER] parameter for dihedral angle

From: Jorgen Simonsen (jorgen589_at_gmail.com)
Date: Fri Jun 05 2009 - 10:16:56 CDT

Hi all,

I have included a metal ion and from literature it seems that the dihedral
angle can disregarded so I set the in a frcmod-file
DIHEDRAL
CR-YA-CU-SM 3 0.75 0.0 3.

but is this a correct way to set it to zero? Any hints or comments
appreciated
thanks in advance

Best

Jorgen
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