A generalized mean field theory of coarse-graining.

نویسندگان

  • Vinod Krishna
  • Luca Larini
چکیده

A general mean field theory is presented for the construction of equilibrium coarse-grained models. Inverse methods that reconstruct microscopic models from low resolution experimental data can be derived as particular implementations of this theory. The theory also applies to the opposite problem of reduction, where relevant information is extracted from available equilibrium ensemble data. Additionally, a complementary approach is presented and problems of representability in coarse-grained modeling analyzed using information theoretic arguments. These problems are central to the construction of coarse-grained representations of complex systems, and commonly used coarse-graining methods and variational principles for coarse-graining are derived as particular cases of the general theory.

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عنوان ژورنال:
  • The Journal of chemical physics

دوره 135 12  شماره 

صفحات  -

تاریخ انتشار 2011