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. Author manuscript; available in PMC: 2014 May 14.
Published in final edited form as: J Chem Theory Comput. 2013 Mar 18;9(5):2226–2234. doi: 10.1021/ct4001087

Table III.

Effective density and fluctuation index of VHD-protein system

Subsystem O1 O2 O3 O3
Environment XWAT1 Asp93 Thr184 XWAT3
Effective density −0.046 −0.064 −0.046 −0.026
Fluctuation index 0.23% 0.17% 0.33% 0.40%