Investigating the Hydrogen Bond-Induced Self-Assembly of Polysulfamides Using Molecular Simulations and Experiments
In this paper, we present a synergistic, experimental, and computational study of the self-
assembly of N, N′-disubstituted polysulfamides driven by hydrogen bonds (H-bonds) …
assembly of N, N′-disubstituted polysulfamides driven by hydrogen bonds (H-bonds) …
100th anniversary of macromolecular science viewpoint: modeling and simulation of macromolecules with hydrogen bonds: challenges, successes, and opportunities
A Jayaraman - ACS Macro Letters, 2020 - ACS Publications
Macromolecular materials with directional interactions such as hydrogen bonds exhibit
numerous attractive features in terms of structure, thermodynamics, and dynamics. Besides …
numerous attractive features in terms of structure, thermodynamics, and dynamics. Besides …
Phase behavior and morphology of blends containing associating polymers: Insights from liquid-state theory and molecular simulations
In this work, we study a symmetric blend of two linear polymers containing associating
functional groups, which upon association form supramolecular copolymers with linear or …
functional groups, which upon association form supramolecular copolymers with linear or …
Additional entanglement effect imposed by small sized ring aggregates in supramolecular polymer melts: molecular dynamics simulation study
E Lee, W Paul - Macromolecules, 2020 - ACS Publications
This work investigates structures and dynamics of supramolecular polymer (SMP) melts
comprising poly (ethylene glycol) s end-functionalized by pairwise associating stickers via …
comprising poly (ethylene glycol) s end-functionalized by pairwise associating stickers via …
Association kinetics and equilibrium in solutions of cross-associating chains that contain inactive spacers
Thermodynamic and kinetic characteristics of chemical reactions in soft matter are affected
by volume exclusion caused by an inert component (crowder). In previous molecular …
by volume exclusion caused by an inert component (crowder). In previous molecular …