Different parts of this project involves collaborative work with NIH scientists, in which sophisticated mathematical tools or an acquaintance with theoretical methods in the physical sciences are required for the research. Mainly these methods require an intimate acquaintance with techniques developed in statistical physics.? To rationalize data on the partioning of PEG-3400 in the alpha-hemolysin channel as a function of function of polymer concentration we have developed a theory of polymer partitioning in cylindrical pores in non-ideal polymer solutions. The theory explains the highly nonlinear increase of partitioning with polymer concentration which has been observed in experiments. ? We discovered a very general property of particle dynamics in channels and similar systems, namely that the distributions of times spent in the channel by particles traversing the channel in opposite directions are always identical in spite of the fact that the translocation probabilities may be quite different.? We developed an approach to extract information related to molecular transitions (e.g., protein folding, ligand dissociation, DNA unzipping) from single-molecule force experiments based on Kramers' theory of diffusive barrier crossing. The theory has been applied to experimental data on nanopore unzipping of individual DNA hairpin molecules. ? We have obtained simple analytical expressions for the time-dependent rate coefficients of diffusion-influenced reactions in the presence of spherically symmetric potentials. These should prove useful in the analysis of experimental data for essentially irreversible reactions such as fluorescence quenching.

Agency
National Institute of Health (NIH)
Institute
Center for Information Technology (CIT)
Type
Intramural Research (Z01)
Project #
1Z01CT000024-32
Application #
7733755
Study Section
Project Start
Project End
Budget Start
Budget End
Support Year
32
Fiscal Year
2008
Total Cost
$85,385
Indirect Cost
Name
Center for Information Technology
Department
Type
DUNS #
City
State
Country
United States
Zip Code
Berezhkovskii, Alexander M; Bezrukov, Sergey M (2008) Fluctuation theorem for channel-facilitated membrane transport of interacting and noninteracting solutes. J Phys Chem B 112:6228-32
Berezhkovskii, Alexander M; Weiss, George H (2008) Propagators and related descriptors for non-Markovian asymmetric random walks with and without boundaries. J Chem Phys 128:044914
Berezhkovskii, Alexander M; Bezrukov, Sergey M (2008) Counting translocations of strongly repelling particles through single channels: fluctuation theorem for membrane transport. Phys Rev Lett 100:038104
Coppey, Mathieu; Boettiger, Alistair N; Berezhkovskii, Alexander M et al. (2008) Nuclear trapping shapes the terminal gradient in the Drosophila embryo. Curr Biol 18:915-9
Shvartsman, Stanislav Y; Coppey, Mathieu; Berezhkovskii, Alexander M (2008) Dynamics of maternal morphogen gradients in Drosophila. Curr Opin Genet Dev 18:342-7
Vazquez, Marco-Vinicio; Berezhkovskii, Alexander M; Dagdug, Leonardo (2008) Diffusion in linear porous media with periodic entropy barriers: A tube formed by contacting spheres. J Chem Phys 129:046101
Bezrukov, Sergey M; Berezhkovskii, Alexander M; Szabo, Attila (2007) Diffusion model of solute dynamics in a membrane channel: mapping onto the two-site model and optimizing the flux. J Chem Phys 127:115101
Dagdug, Leonardo; Berezhkovskii, Alexander M; Makhnovskii, Yurii A et al. (2007) Transient diffusion in a tube with dead ends. J Chem Phys 127:224712
Berezhkovskii, A M; Pustovoit, M A; Bezrukov, S M (2007) Diffusion in a tube of varying cross section: numerical study of reduction to effective one-dimensional description. J Chem Phys 126:134706
Berezhkovskii, A M; Barzykin, A V (2007) Simple formulas for the trapping rate by nonspherical absorber and capacitance of nonspherical conductor. J Chem Phys 126:106102

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