Effects of alignment activity on the collapse kinetics of a flexible polymer. Issue 10 (13th January 2022)

• Record Type: Journal Article
• Authors: Paul, Subhajit; Majumder, Suman; Das, Subir K.; Janke, Wolfhard
• Is Part Of: Soft matter. Volume 18:Issue 10(2022)
• Page Start: 1978
• Page End: 1990
• Publication Date: 2022-01-13
• Subjects: Soft condensed matter -- Periodicals; 530.413
• DOI: 10.1039/d1sm01055g
• Languages: English
• ISSNs: 1744-683X

Abstract

Abstract : The nonequilibrium kinetics of various biological filaments can be understood within the framework of active polymer models. Increasing the alignment activity of monomers changes the intermediates during collapse from pearl-necklace to dumbbell-like conformations. Abstract : The dynamics of various biological filaments can be understood within the framework of active polymer models. Here we consider a bead-spring model for a flexible polymer chain in which the active interaction among the beads is introduced via an alignment rule adapted from the Vicsek model. Following quenching from the high-temperature coil phase to a low-temperature state point, we study the coarsening kinetics via molecular dynamics (MD) simulations using the Langevin thermostat. For the passive polymer case the low-temperature equilibrium state is a compact globule. The results from our MD simulations reveal that though the globular state is also the typical final state in the active case, the nonequilibrium pathways to arrive at such a state differ from the picture for the passive case due to the alignment interaction among the beads. We notice that deviations from the intermediate "pearl-necklace"-like arrangement, which is observed in the passive case, and the formation of more elongated dumbbell-like structures increase with increasing activity. Furthermore, it appears that while a small active force on the beads certainly makes the coarsening process much faster, there exists a nonmonotonic dependence of the collapse time on the strength of active interaction. We quantify these observations by comparing the scaling laws for the collapse time and growth of pearls with the passive case.