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Full-Text Articles in Probability

Aspects Of Stochastic Geometric Mechanics In Molecular Biophysics, David Frost Dec 2023

Aspects Of Stochastic Geometric Mechanics In Molecular Biophysics, David Frost

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In confocal single-molecule FRET experiments, the joint distribution of FRET efficiency and donor lifetime distribution can reveal underlying molecular conformational dynamics via deviation from their theoretical Forster relationship. This shift is referred to as a dynamic shift. In this study, we investigate the influence of the free energy landscape in protein conformational dynamics on the dynamic shift by simulation of the associated continuum reaction coordinate Langevin dynamics, yielding a deeper understanding of the dynamic and structural information in the joint FRET efficiency and donor lifetime distribution. We develop novel Langevin models for the dye linker dynamics, including rotational dynamics, based …


Advancements In Gaussian Process Learning For Uncertainty Quantification, John C. Nicholson May 2022

Advancements In Gaussian Process Learning For Uncertainty Quantification, John C. Nicholson

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Gaussian processes are among the most useful tools in modeling continuous processes in machine learning and statistics. The research presented provides advancements in uncertainty quantification using Gaussian processes from two distinct perspectives. The first provides a more fundamental means of constructing Gaussian processes which take on arbitrary linear operator constraints in much more general framework than its predecessors, and the other from the perspective of calibration of state-aware parameters in computer models. If the value of a process is known at a finite collection of points, one may use Gaussian processes to construct a surface which interpolates these values to …


Some Improved Markov Chain Convergence Rates, Fun Choi John Chan May 2022

Some Improved Markov Chain Convergence Rates, Fun Choi John Chan

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Explicit convergence rates to equilibrium are established for non reversible Markov chains not having an atom via coupling methods. We consider two Markov chains having the same transition function but different initial conditions on the same probability space, that is, a coupling. A random time is constructed so that subsequent to the random time the two processes are identical. Exploiting a shadowing condition, we show that it is possible to bound the tail distribution of the random time using only one of the chains. This bound gives the convergence rate to equilibrium for the Markov chain. The method is then …