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Anomalously strong finite-size effects have been observed for the mean square radius of gyration $R^2_K$ of Gaussian random polygons with a fixed knot $K$ as a function of the number $N$ of polygonal nodes. Through computer simulations with…

Soft Condensed Matter · Physics 2009-03-26 Miyuki K. Shimamura , Tetsuo Deguchi

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 consider the topologically constrained random walk model for topological polymers. In this model, the polymer forms an arbitrary graph whose edges are selected from an appropriate multivariate Gaussian which takes into account the…

Statistical Mechanics · Physics 2022-11-30 Jason Cantarella , Tetsuo Deguchi , Clayton Shonkwiler , Erica Uehara

We find a power law for the number of knot-monomers with an exponent $0.39 \pm0.13$ in agreement with previous simulations. For the average size of a knot we also obtain a power law $N_m=2.56\cdot N^{0.20\pm0.04}$. We further present data…

Soft Condensed Matter · Physics 2007-05-23 Michael Brill , Philipp M. Diesinger , Dieter W. Heermann

Using Monte Carlo simulations and advanced knot localization methods, we analyze the length and distribution of prime components in composite knots tied on Freely Jointed Rings (FJRs). For increasing contour length, we observe the…

Statistical Mechanics · Physics 2015-06-18 Luca Tubiana

We have examined the behaviors of a knotted linear polymer in narrow tubes using Langevin dynamics simulation to investigate the knot localization property in one-dimensional (1D) geometry. We have found that the knot is strongly localized…

Soft Condensed Matter · Physics 2012-06-05 Chihiro H. Nakajima , Takahiro Sakaue

We study how confinement affects topology and conformations in polymer films of varying thickness $h$. The knotting probability exhibits a maximum at intermediate thicknesses near the bulk radius of gyration $h \approx R_\mathrm{g,bulk}$,…

Soft Condensed Matter · Physics 2026-05-05 Maurice P. Schmitt , Hendrik Meyer , Peter Virnau

Inspired by how certain proteins "sense" knots and entanglements in DNA molecules, here we ask if there exist local geometric features that may be used as a read-out of the underlying topology of generic polymers. We perform molecular…

We study experimentally statistical properties of the opening times of knots in vertically vibrated granular chains. Our measurements are in good qualitative and quantitative agreement with a theoretical model involving three random walks…

Soft Condensed Matter · Physics 2007-05-23 E. Ben-Naim , Z. A. Daya , P. Vorobieff , R. E. Ecke

We discuss the probability of random knotting for a model of self-avoiding polygons whose segments are given by cylinders of unit length with radius $r$. We show numerically that the characteristic length of random knotting is roughly…

Statistical Mechanics · Physics 2009-10-31 Miyuki K. shimamura , Tetsuo Deguchi

We discuss the entropy of a circular polymer under a topological constraint. We call it the {\it topological entropy} of the polymer, in short. A ring polymer does not change its topology (knot type) under any thermal fluctuations. Through…

Statistical Mechanics · Physics 2009-11-07 Miyuki K. Shimamura , Tetso Deguchi

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

The knotting probability is defined by the probability with which an $N$-step self-avoiding polygon (SAP) with a fixed type of knot appears in the configuration space. We evaluate these probabilities for some knot types on a simple cubic…

Statistical Mechanics · Physics 2009-11-07 Akihisa Yao , Hiroshi Matsuda , Hiroshi Tsukahara , Miyuki K. Shimamura , Tetsuo Deguchi

We consider a natural model of random knotting- choose a knot diagram at random from the finite set of diagrams with n crossings. We tabulate diagrams with 10 and fewer crossings and classify the diagrams by knot type, allowing us to…

Geometric Topology · Mathematics 2016-10-12 Jason Cantarella , Harrison Chapman , Matt Mastin

Simulations in which a globular ring polymer with delocalized knots is separated in two interacting loops by a slipping link, or in two non-interacting globuli by a wall with a hole, show how the minimal crossing number of the knots…

Soft Condensed Matter · Physics 2011-10-17 M. Baiesi , E. Orlandini , A. L. Stella , F. Zonta

For a polygonal knot K, it is shown that a tube of radius R(K), the polygonal thickness radius, is an embedded torus. Given a thick configuration K, perturbations of size r<R(K) define satellite structures, or local knotting. We explore…

Geometric Topology · Mathematics 2007-05-23 Kenneth C. Millett , Michael Piatek , Eric J. Rawdon

We prove the fractal crumpled structure of collapsed unknotted polymer ring. In this state the polymer chain forms a system of densely packed folds, mutually separated in all scales. The proof is based on the numerical and analytical…

Statistical Mechanics · Physics 2007-05-23 Sergei Nechaev , Oleg Vasilyev

We examine numerically the distribution function $f_K(r)$ of distance $r$ between opposite polygonal nodes for random polygons of $N$ nodes with a fixed knot type $K$. Here we consider three knots such as $\emptyset$, $3_1$ and $3_1 \sharp…

Soft Condensed Matter · Physics 2009-11-10 Akihisa Yao , Hiroshi Tsukahara , Tetsuo Deguchi , Takeo Inami

The size of a zero thickness (no excluded volume) polymer ring is shown to scale with chain length $N$ in the same way as the size of the excluded volume (self-avoiding) linear polymer, as $N^{\nu}$, where $\nu \approx 0.588$. The…

Soft Condensed Matter · Physics 2009-10-31 Alexander Yu. Grosberg

Semiflexible polymer models are widely used as a paradigm to understand structural phases in biomolecules including folding of proteins. Since stable knots are not so common in real proteins, the existence of stable knots in semiflexible…

Soft Condensed Matter · Physics 2021-07-14 Suman Majumder , Martin Marenz , Subhajit Paul , Wolfhard Janke