High-Throughput Absorbance-Activated Droplet Sorting for Engineering Aldehyde Dehydrogenases.

Recent decades have seen a dramatic increase in the commercial use of biocatalysts, transitioning from energy-intensive traditional chemistries to more sustainable methods. Current enzyme engineering techniques, such as directed evolution, require the generation and testing of large mutant libraries to identify optimized variants. Unfortunately, conventional screening methods are unable to screen such large libraries in a robust and timely manner.

Biocatalytic Conversion of Carrageenans for the Production of 3,6-Anhydro-D-galactose.

Marine biomass stands out as a sustainable resource for generating value-added chemicals. In particular, anhydrosugars derived from carrageenans exhibit a variety of biological functions, rendering them highly promising for utilization and cascading in food, cosmetic, and biotechnological applications. However, the limitation of available sulfatases to break down the complex sulfation patterns of carrageenans poses a significant limitation for the sustainable production of valuable bioproducts from red algae.

Effect of microstructure evolution on the mechanical behavior of magneto-active elastomers with different matrix stiffness.

Evolution of microstructure in magneto-active elastomers (MAEs) which can be caused by an applied magnetic field is a fascinating phenomenon with a significant impact on the mechanical behavior of the composite. To gain insight into the underlying mechanisms of this phenomenon, it is essential to create a model that can appropriately describe the field induced change in the particle distribution and its mechanical implications. The magneto-mechanical coupling is driven by magnetic interactions between the particles in the applied field.

Theoretical analysis of the elastic free energy contributions to polymer brushes in poor solvent: A refined mean-field theory.

We consider polymer brushes in poor solvent that are grafted onto planar substrates and onto the internal and external surfaces of a cylinder using molecular dynamics simulation, self-consistent field (SCF), and mean-field theory. We derive a unified expression for the mean field free energy for the three geometrical classes. While for low grafting densities, the effect of chain elasticity can be neglected in poor solvent conditions, it becomes relevant at higher grafting densities and, in particular, for concave geometries.

Magneto-Mechanical Enhancement of Elastic Moduli in Magnetoactive Elastomers with Anisotropic Microstructures.

Magnetoactive elastomers (MAEs) have gained significant attention in recent years due to their wide range of engineering applications. This paper investigates the important interplay between the particle microstructure and the sample shape of MAEs. A simple analytical expression is derived based on geometrical arguments to describe the particle distribution inside MAEs.

Field-Induced Transversely Isotropic Shear Response of Ellipsoidal Magnetoactive Elastomers.

Magnetoactive elastomers (MAEs) claim a vital place in the class of field-controllable materials due to their tunable stiffness and the ability to change their macroscopic shape in the presence of an external magnetic field. In the present work, three principal geometries of shear deformation were investigated with respect to the applied magnetic field. The physical model that considers dipole-dipole interactions between magnetized particles was used to study the stress-strain behavior of ellipsoidal MAEs.

A Cascading Mean-Field Approach to the Calculation of Magnetization Fields in Magnetoactive Elastomers.

We consider magnetoactive elastomer samples based on the elastic matrix and magnetizable particle inclusions. The application of an external magnetic field to such composite samples causes the magnetization of particles, which start to interact with each other. This interaction is determined by the magnetization field, generated not only by the external magnetic field but also by the magnetic fields arising in the surroundings of interacting particles.

Magneto-Mechanical Coupling in Magneto-Active Elastomers.

In the present work, the magneto-mechanical coupling in magneto-active elastomers is investigated from two different modeling perspectives: a micro-continuum and a particle-interaction approach. Since both strategies differ significantly in their basic assumptions and the resolution of the problem under investigation, they are introduced in a concise manner and their capabilities are illustrated by means of representative examples. To motivate the application of these strategies within a hybrid multiscale framework for magneto-active elastomers, their interchangeability is then examined in a systematic comparison of the model predictions with regard to the magneto-deformation of chain-like helical structures in an elastomer surrounding.

Magnetic-field-induced stress in confined magnetoactive elastomers.

We present a theoretical approach for calculating the state of stress induced by a uniform magnetic field in confined magnetoactive elastomers of arbitrary shape. The theory explicitly includes the magnetic field generated by magnetizable spherical inclusions in the sample interior assuming a non-linear magnetization behavior. The initial spatial distribution of particles and its change in an external magnetic field are considered.

Giant Extensional Strain of Magnetoactive Elastomeric Cylinders in Uniform Magnetic Fields.

Elongations of magnetoactive elastomers (MAEs) under ascending-descending uniform magnetic fields were studied experimentally using a laboratory apparatus specifically designed to measure large extensional strains (up to 20%) in compliant MAEs. In the literature, such a phenomenon is usually denoted as giant magnetostriction. The synthesized cylindrical MAE samples were based on polydimethylsiloxane matrices filled with micrometer-sized particles of carbonyl iron.

Effects of local rearrangement of magnetic particles on deformation in magneto-sensitive elastomers.

Based on the dipole-dipole approach for magnetic interactions we present a comprehensive analysis of spatial rearrangement of magnetic particles under a magnetic field and its effect on the magneto-induced deformation of magneto-sensitive elastomers. The presented formalism allows analyzing non-affine displacements of magnetic particles in a general way and reveals how the local rearrangement of particles under a magnetic field affects the magneto-induced deformation. The formalism includes two contributions: (1) displacements due to elastic coupling with a deformed matrix and (2) rearrangements on the background of the deformed matrix due to magnetic interactions between the particles.

Impact of Bioactive Peptide Motifs on Molecular Structure, Charging, and Nonfouling Properties of Poly(ethylene oxide) Brushes.

Polymer layers capable of suppressing protein adsorption from biological media while presenting extracellular matrix-derived peptide motifs offer valuable new options for biomimetic surface engineering. Herein, we provide detailed insights into physicochemical changes induced in a nonfouling poly(ethylene oxide) (PEO) brush/polydopamine (PDA) system by incorporation of adhesion ligand (RGD) peptides. Brushes with high surface chain densities (σ ≥ 0.

Theoretical models for magneto-sensitive elastomers: A comparison between continuum and dipole approaches.

In the literature, different theoretical models have been proposed to describe the properties of systems which consist of magnetizable particles that are embedded into an elastomer matrix. It is well known that such magneto-sensitive elastomers display a strong magneto-mechanical coupling when subjected to an external magnetic field. Nevertheless, the predictions of available models often vary significantly since they are based on different assumptions and approximations.

Elongated micro-structures in magneto-sensitive elastomers: a dipolar mean field model.

Based on a dipole model for the mutual magnetic interactions among the magnetizable micro-particles in magneto-sensitive elastomers we develop a mean field approach to describe the arrangement of these particles into elongated micro-structures. If these micro-structures are oriented parallel to an external magnetic field the present approach provides an efficient calculation of the behavior of such samples, which is a result of the interplay between micro-structure and shape effects. Accordingly, we are able to draw comprehensive phase diagrams for the resultant deformation and predict for very oblate samples a discontinuous shape change in the presence of a homogeneous external field.

Binary and Bidisperse Polymer Brushes: Coexisting Surface States.

In the present work, we consider polydispersity effects on a mixed polymer brush. Two types of polymer chains with different solvent selectivity being densely grafted together onto an impenetrable surface are forming a binary mixed polymer brush. Using a numerical quasi off-lattice self-consistent field method for heterogeneous chains we study the brush profile upon varying the strength of solvent selectivity (e.

Excluded volume effects in polymer brushes at moderate chain stretching.

We develop a strong stretching approximation for a polymer brush made of self-avoiding polymer chains. The density profile of the brush and the distribution of the end monomer positions in stretching direction are computed and compared with simulation data. We find that our approach leads to a clearly better approximation as compared to previous approaches based upon Gaussian elasticity at low grafting densities (moderate chain stretching), for which corrections due to finite extensibility can be ignored.

Electrokinetics as an alternative to neutron reflectivity for evaluation of segment density distribution in PEO brushes.

Unravelling details of charge, structure and molecular interactions of functional polymer coatings defines an important analytical challenge that requires the extension of current methodologies. In this article we demonstrate how streaming current measurements interpreted with combined self consistent field (SCF) and soft surface electrokinetic theories allow the evaluation of the segment distribution within poly(ethylene oxide) (PEO) brushes beyond the resolution limits of neutron reflectivity technique.

Conformational switching of modified guest chains in polymer brushes.

Using a numerical quasi off-lattice self-consistent field method which describes heterogeneous chains of spherical monomers we study the case of a densely grafted polymer brush with a fraction of free chain ends being replaced by a modified end-group differing in size and solvent selectivity. We can confirm the observation from molecular dynamics simulations that upon changing the solvent conditions, a switching in location of end-groups which are bigger than monomers from a state "exposed" to the solvent (on the top of the brush) to a "hidden" state (inside the brush) takes place. Our numerical method allows a detailed study of the switching effect as a function of the relevant parameters, such as grafting density, chain length, size of end-groups and their volume fraction.

Surface instabilities of minority chains in dense polymer brushes: a comparison of density functional theory and quasi-off-lattice self-consistent field theory.

This work studies surface instabilities in switchable homopolymer brushes where the minority chain differs in length from the brush chains. Both off-lattice numerical self-consistent field theory and classical density functional theory are employed. It is found that the two methods agree well with each other as long as the same equation of state for the polymer chains is used.

A new numerical approach to dense polymer brushes and surface instabilities.

We present a numerical self-consistent field (SCF) method which describes freely jointed chains of spherical monomers applied to densely grafted polymer brushes. We discuss both the Flory-Huggins model and the Carnahan-Starling equation of state and show the latter being preferable within our model at polymer volume fractions above 10%. We compare the results of our numerical method with data from molecular dynamics (MD) simulations [G.

Adsorption of random copolymers from a melt onto a solid surface: Monte Carlo studies.

We study the behavior of random AB-copolymer melts near a selective surface. We consider the case where the copolymers do not display phase segregation behavior in the bulk but the surface is strongly selective for the A-component and the probability of finding an A-monomer along the chain is p<<1. Using self-consistent field theory and scaling arguments, we discuss some aspects of conformational rearrangements and composition selection in the surface layer.

Polymer chains in confined geometries: massive field theory approach.

The massive field theory approach in fixed space dimensions d<4 is applied to investigate a dilute solution of long-flexible polymer chains in a good solvent between two parallel repulsive walls, two inert walls, and for the mixed case of one inert and one repulsive wall. The well-known correspondence between the field theoretical phi4 O(n) -vector model in the limit n-->0 and the behavior of long-flexible polymer chains in a good solvent is used to calculate the depletion interaction potential and the depletion force up to one-loop order. In order to make the theory UV finite in renormalization-group sense in 3 View Article and Find Full Text PDF