Progressive polymer deformation induced by polar activity and the influence of inertia

AR Tejedor, J Ramírez, M Ripoll - Physical Review Research, 2024 - APS
Polar activity is shown here to induce a progressive local deformation of linear polymer
chains, making a clear distinction between head and tail, while the overall chain …

Local polar and long-range isotropic activity assisted swelling and collapse dynamics of an active ring polymer

S Kumar, S Thakur - Macromolecules, 2023 - ACS Publications
The circular and ring structures in many synthetic or natural systems simultaneously
experience local and long-range forces. In this work, we use numerical simulations to …

Attractive crowding effect on passive and active polymer loo** kinetics

R Yan, C Zhao, N Zhao - The Journal of Chemical Physics, 2024 - pubs.aip.org
Loop formation in complex environments is crucially important to many biological processes
in life. In the present work, we adopt three-dimensional Langevin dynamics simulations to …

Enhanced diffusion and universal Rouse-like scaling of an active polymer in poor solvent

S Majumder, S Paul, W Janke - Physical Review Materials, 2024 - APS
By means of Brownian dynamics simulations we study the steady-state dynamic properties
of a flexible active polymer in a poor solvent condition. Our results show that the effective …

Activity mediated globule to coil transition of a flexible polymer in a poor solvent

S Paul, S Majumder, W Janke - Soft Matter, 2022 - pubs.rsc.org
Understanding the role of self-propulsion on the conformational properties of active
filamentous objects has relevance in biology. In this work, we consider a flexible bead …

Coil–globule transition of a water-soluble polymer

J Liu, H Guo, Q Gao, H Li, Z An, W Zhang - Macromolecules, 2022 - ACS Publications
The coil–globule transition is a fundamental issue in polymer science and key to the
performance of many smart materials. However, an experimental study on the globule …

[HTML][HTML] Molecular dynamics simulations of active entangled polymers reptating through a passive mesh

AR Tejedor, R Carracedo, J Ramírez - Polymer, 2023 - Elsevier
The dynamics of active entangled chains using molecular dynamics simulations of a
modified Kremer–Grest model. The active chains are diluted in a mesh of very long passive …

Conformation and dynamics of an active filament in crowded media

R Yan, F Tan, J Wang, N Zhao - The Journal of Chemical Physics, 2023 - pubs.aip.org
The structural and dynamical properties of active filamentous objects under macromolecular
crowding have a great relevance in biology. By means of Brownian dynamics simulations …

Recent progress in non-equilibrium structure and dynamics of connected active agents

Y Zhang, W Tian - Journal of Physics: Condensed Matter, 2025 - iopscience.iop.org
Active agents, which convert energy into directed motion, are inherently non-equilibrium
systems. Inspired by living organisms and polymer physics, connected active agents with …

Long-range ordering of velocity-aligned active polymers

VY Rudyak, A Lopushenko, VV Palyulin… - The Journal of …, 2024 - pubs.aip.org
In this work, we study the effect of covalent bonding on the behavior of non-equilibrium
systems with the active force acting on particles along their velocity. Self-ordering of single …