Skip to main content
. Author manuscript; available in PMC: 2014 Aug 13.
Published in final edited form as: J Chem Theory Comput. 2013 Jun 18;9(8):3311–3320. doi: 10.1021/ct400313n

Figure 5.

Figure 5

Sampled torsions. In green circles we show the four atoms that are active in a particular torsion. Sometimes torsion parameters are modeled only according to the central two atoms. Here we take the broader view and consider torsions with even one of the four atoms different as distinct.