The physics of the glass transition and amorphous materials continues to attract the attention
of a wide research community after decades of effort. Supercooled liquids and glasses have …

Faced with desiccation stress, many organisms deploy strategies to maintain the integrity of
their cellular components. Amorphous glassy media composed of small molecular solutes or …

We combine the swap Monte Carlo algorithm to long multi-CPU molecular dynamics
simulations to analyze the equilibrium relaxation dynamics of model supercooled liquids …

The Martini model, a coarse‐grained force field initially developed with biomolecular
simulations in mind, has found an increasing number of applications in the field of soft …

The multiscale dynamical behaviors of reversible cross-linked networks (vitrimers) are
investigated using coarse-grained molecular dynamics simulations, revealing that these …

The nature of alterations to dynamics and vitrification in the nanoscale vicinity of interfaces—
commonly referred to as “nanoconfinement” effects on the glass transition—has been an …

We extend previous systematic investigations of a family of model coarse-grained polymer
network-forming materials by focusing on the influence of varying molecular rigidity on basic …

Recent advances in graphics processing unit (GPU) hardware and improved efficiencies of
atomistic simulation programs allow for the screening of a large number of polymers to …

Molecular, polymeric, colloidal, and other classes of liquids can exhibit very large, spatially
heterogeneous alterations of their dynamics and glass transition temperature when confined …

Machine learning (ML) and artificial intelligence (AI) have remarkable abilities to classify,
recognize, and characterize complex patterns and trends in large data sets. Here, we adopt …