In many experiments, the aim is to deduce an underlying multi-substate on-off kinetic scheme (KS) from the statistical properties of a two-state trajectory. However, the mapping of a KS into a two-state trajectory leads to the loss of information abo
ut the KS, and so, in many cases, more than one KS can be associated with the data. We recently showed that the optimal way to solve this problem is to use canonical forms of reduced dimensions (RD). RD forms are on-off networks with connections only between substates of different states, where the connections can have non-exponential waiting time probability density functions (WT-PDFs). In theory, only a single RD form can be associated with the data. To utilize RD forms in the analysis of the data, a RD form should be associated with the data. Here, we give a toolbox for building a RD form from a finite two-state trajectory. The methods in the toolbox are based on known statistical methods in data analysis, combined with statistical methods and numerical algorithms designed specifically for the current problem. Our toolbox is self-contained - it builds a mechanism based only on the information it extracts from the data, and its implementation on the data is fast (analyzing a 10^6 cycle trajectory from a thirty-parameter mechanism takes a couple of hours on a PC with a 2.66 GHz processor). The toolbox is automated and is freely available for academic research upon electronic request.
The diffusion process of N hard rods in a 1D interval of length L (--> inf) is studied using scaling arguments and an asymptotic analysis of the exact N-particle probability density function (PDF). In the class of such systems, the universal scaling
law of the tagged particles mean absolute displacement reads, <|r|>~ <|r|>_{free}/n^mu, where <|r|>_{free} is the result for a free particle in the studied system and n is the number of particles in the covered length. The exponent mu is given by, mu=1/(1+a), where a is associated with the particles density law of the system, rho~rho_0*L^(-a), 0<= a <=1. The scaling law for <|r|> leads to, <|r|>~rho_0^((a-1)/2) (<|r| >_{free})^((1+a)/2), an equation that predicts a smooth interpolation between single file diffusion and free particle diffusion depending on the particles density law, and holds for any underlying dynamics. In particular, <|r|>~t^((1+a)/2) for normal diffusion, with a Gaussian PDF in space for any value of a (deduced by a complementary analysis), and, <|r|>~t^((beta(1+a))/2), for anomalous diffusion in which the systems particles all have the same power-law waiting time PDF for individual events, psi~t^(-1-beta), 0<beta<1. Our analysis shows that the scaling <|r|>~t^(1/2) in a standard single file is a direct result of the fixed particles density condition imposed on the system, a=0.
In random walks, the path representation of the Greens function is an infinite sum over the length of path probability density functions (PDFs). Here we derive and solve, in Laplace space, the recursion relation for the n order path PDF for any arbit
rarily inhomogeneous semi-Markovian random walk in a one-dimensional (1D) chain of L states. The recursion relation relates the n order path PDF to L/2 (round towards zero for an odd L) shorter path PDFs, and has n independent coefficients that obey a universal formula. The z transform of the recursion relation straightforwardly gives the generating function for path PDFs, from which we obtain the Greens function of the random walk, and derive an explicit expression for any path PDF of the random walk. These expressions give the most detailed description of arbitrarily inhomogeneous semi-Markovian random walks in 1D.
