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Scaling arguments are used to analyze the size of topologically constrained closed ring polymer with excluded volume. It is found that there exists a finite range of polymer thickness (excluded volume) in which self-avoidance is unimportant…

Soft Condensed Matter · Physics 2007-05-23 A. Yu. Grosberg

We define the knotting probability of a knot $K$ by the probability for a random polygon (RP) or self-avoiding polygon (SAP) of $N$ segments having the knot type $K$. We show fundamental and generic properties of the knotting probability…

Soft Condensed Matter · Physics 2017-10-11 Erica Uehara , Tetsuo Deguchi

Several nontrivial properties are shown for the mean square radius of gyration $R_K^2$ of ring polymers with a fixed knot type K. Through computer simulation, we discuss both finite-size and asymptotic behaviors of the gyration radius under…

Soft Condensed Matter · Physics 2009-11-07 Miyuki K. Shimamura , Tetsuo Deguchi

We have evaluated by numerical simulation the average size $R_K$ of random polygons of fixed knot topology $K = \emptyset, 3_1, 3_1\sharp4_1$, and we have confirmed the scaling law $R^2_K \sim N^{2\nu_K}$ for the number $N$ of polygonal…

Statistical Mechanics · Physics 2009-11-10 Hiroshi Matsuda , Akihisa Yao , Hiroshi Tsukahara , Tetsuo Deguchi , Ko Furuta , Takeo Inami

It is nontrivial whether the average size of a ring polymer should become smaller or larger under a topological constraint. Making use of some knot invariants, we evaluate numerically the mean square radius of gyration for ring polymers…

Statistical Mechanics · Physics 2016-08-31 Miyuki K. Shimamura , Tetsuo Deguchi

Large scale molecular dynamics simulations on graphic processing units (GPUs) are employed to study the scaling behavior of ring polymers with various topological constraints in melts. Typical sizes of rings containing $3_1$, $5_1$ knots…

Soft Condensed Matter · Physics 2015-09-04 Benjamin Trefz , Peter Virnau

By performing Monte Carlo sampling of $N$-steps self-avoiding polygons embedded on different Bravais lattices we explore the robustness of universality in the entropic, metric and geometrical properties of knotted polymer rings. In…

Statistical Mechanics · Physics 2013-01-21 Marco Baiesi , Enzo Orlandini

The work addresses the analogy between trivial knotting and excluded volume in looped polymer chains of moderate length, $N<N_0$, where the effects of knotting are small. A simple expression for the swelling seen in trivially knotted loops…

Soft Condensed Matter · Physics 2007-05-23 N. T. Moore , A. Y. Grosberg

Numerical studies of the average size of trivially knotted polymer loops with no excluded volume are undertaken. Topology is identified by Alexander and Vassiliev degree 2 invariants. Probability of a trivial knot, average gyration radius,…

Soft Condensed Matter · Physics 2009-11-10 N. T. Moore , R. Lua , A. Y. Grosberg

We give two different, statistically consistent definitions of the length l of a prime knot tied into a polymer ring. In the good solvent regime the polymer is modelled by a self avoiding polygon of N steps on cubic lattice and l is the…

Statistical Mechanics · Physics 2015-06-25 B. Marcone , E. Orlandini , A. L. Stella , F. Zonta

We consider the probability of knotting in equilateral random polygons in Euclidean 3-dimensional space, which model, for instance, random polymers. Results from an extensive Monte Carlo dataset of random polygons indicate a universal…

Statistical Mechanics · Physics 2022-04-15 A. Xiong , A. J. Taylor , M. R. Dennis , S. G. Whittington

We analyse new exact enumeration data for self-avoiding polygons, counted by perimeter and area on the square, triangular and hexagonal lattices. In extending earlier analyses, we focus on the perimeter moments in the vicinity of the…

Statistical Mechanics · Physics 2008-08-28 C. Richard , I. Jensen , A. J. Guttmann

The statistical mechanics of a long knotted collapsed polymer is determined by a free-energy with a knot-dependent subleading term, which is linked to the length of the shortest polymer that can hold such knot. The only other parameter…

Statistical Mechanics · Physics 2014-12-01 Marco Baiesi , Enzo Orlandini , Attilio L. Stella

The role of the topology and its relation with the geometry of biopolymers under different physical conditions is a nontrivial and interesting problem. Aiming at understanding this issue for a related simpler system, we use Monte Carlo…

Statistical Mechanics · Physics 2009-10-22 Marco Baiesi , Enzo Orlandini , Stuart G. Whittington

We investigate the knotting probability after a local strand passage is performed in an unknotted self-avoiding polygon on the simple cubic lattice. We assume that two polygon segments have already been brought close together for the…

Statistical Mechanics · Physics 2015-05-27 M. L. Szafron , C. E. Soteros

Folklore has, that the universal scaling properties of linear polymers in disordered media are well described by the statistics of self-avoiding walks Folklore has, that the universal scaling properties of linear polymers in disordered…

Statistical Mechanics · Physics 2015-06-25 Hans-Karl Janssen , Olaf Stenull

Let $p_n$ denote the number of self-avoiding polygons of length $n$ on a regular three-dimensional lattice, and let $p_n(K)$ be the number which have knot type $K$. The probability that a random polygon of length $n$ has knot type $K$ is…

Statistical Mechanics · Physics 2015-05-27 E. J. Janse van Rensburg , A. Rechnitzer

We present a computer simulation study of the compact self-avoiding loops as regards their length and topological state. We use a Hamiltonian closed path on the cubic-shaped segment of a 3D cubic lattice as a model of a compact polymer. The…

Soft Condensed Matter · Physics 2007-05-23 R. C. Lua , N. T. Moore , A. Yu. Grosberg

We consider self-avoiding polymers attached to the tip of an impenetrable probe. The scaling exponents $\gamma_1$ and $\gamma_2$, characterizing the number of configurations for the attachment of the polymer by one end, or at its midpoint,…

Statistical Mechanics · Physics 2007-05-23 Michael Slutsky , Roya Zandi , Yacov Kantor , Mehran Kardar

We investigate the Rouse dynamics of a flexible ring polymer with a prime knot. Within a Monte Carlo approach, we locate the knot, follow its diffusion, and observe the fluctuations of its length. We characterise a topological time scale,…

Statistical Mechanics · Physics 2007-05-23 Enzo Orlandini , Attilio L. Stella , Carlo Vanderzande , Francesco Zonta
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