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Non-Markovian closure kinetics of flexible polymers with hydrodynamic interactions
- Source :
- Journal of Chemical Physics, Journal of Chemical Physics, 2015, 143 (20), pp.204108 (1-10). ⟨10.1063/1.4935966⟩, Journal of Chemical Physics, American Institute of Physics, 2015, 143 (20), pp.204108 (1-10). ⟨10.1063/1.4935966⟩
- Publication Year :
- 2015
- Publisher :
- HAL CCSD, 2015.
-
Abstract
- International audience; This paper presents a theoretical analysis of the closure kinetics of a polymer with hydrodynamic interactions. This analysis, which takes into account the non-Markovian dynamics of the end-to-end vector and relies on the preaveraging of the mobility tensor (Zimm dynamics), is shown to reproduce very accurately the results of numerical simulations of the complete nonlinear dynamics. It is found that Markovian treatments based on a Wilemski-Fixman approximation significantly overestimate cyclization times (up to a factor 2), showing the importance of memory effects i n t he dynamics. In addition, this analysis provides scaling laws of the mean first cyclization time (MFCT) with the polymer size N and capture radius b, which are identical in both Markovian and non-Markovian approaches. In particular, it is found that the scaling of the MFCT for large N is given by T ∼ N 3/2 ln(N/b 2), which differs from the case of the Rouse dynamics where T ∼ N 2. The extension to the case of the reaction kinetics of a monomer of a Zimm polymer with an external target in a confined volume is also presented.
- Subjects :
- Physics
Quantitative Biology::Biomolecules
Statistical Mechanics (cond-mat.stat-mech)
Dynamics (mechanics)
Kinetics
General Physics and Astronomy
Markov process
FOS: Physical sciences
Radius
Condensed Matter::Soft Condensed Matter
Nonlinear system
symbols.namesake
Closure (mathematics)
symbols
Tensor
Statistical physics
[PHYS.PHYS.PHYS-CHEM-PH]Physics [physics]/Physics [physics]/Chemical Physics [physics.chem-ph]
Physical and Theoretical Chemistry
Scaling
Condensed Matter - Statistical Mechanics
Subjects
Details
- Language :
- English
- ISSN :
- 00219606 and 10897690
- Database :
- OpenAIRE
- Journal :
- Journal of Chemical Physics, Journal of Chemical Physics, 2015, 143 (20), pp.204108 (1-10). ⟨10.1063/1.4935966⟩, Journal of Chemical Physics, American Institute of Physics, 2015, 143 (20), pp.204108 (1-10). ⟨10.1063/1.4935966⟩
- Accession number :
- edsair.doi.dedup.....c67f59db5631792320425782834357ca
- Full Text :
- https://doi.org/10.1063/1.4935966⟩