Polymer Density Research Articles

Engineering Nanoclusters of Cell Adhesive Ligands on Biomaterial Surfaces: Superior Cell Proliferation and Myotube Formation for Skeletal Muscle Tissue Regeneration.

Engineering biointerfaces with nanoscale clustering of integrin-binding cell adhesive peptides is critical for promoting receptor redistribution into signaling complexes. Skeletal muscle cells are exquisitely sensitive to integrin-mediated signaling, yet biomaterials supporting myogenesis through control of the density and nanodistribution of ligands have not been developed. Here, materials are developed with tailorable cell adhesive ligands distribution at the interface by independently controlling their global and local density to enhance myogenesis, by promoting myoblast growth and myotube formation. To this end, RGD-functionalized low-fouling polymer surfaces with global ligand densities (G) from 0-7µg peptide/mg polymer and average local ligand densities (L) from 1-6.3 ligands/cluster, are generated and characterized. Cell studies demonstrate improvements in cell adhesion, spreading, growth, and myotube formation up to a density of 7µg peptide/mg polymer with 4 ligands/cluster. Optimizing ligand density and distribution also promotes early myofiber maturation, identified by increased MF20 marker protein expression and sarcomere-forming myotubes. At higher ligand densities, these cell properties are decreased, indicating that ligand multivalency is a critical parameter for tailoring cell-material interactions, to a certain threshold. The findings provide new insights for designing next-generation biomaterials and hold promise for improved engineering of skeletal muscle.

Intrinsic Synergy and Selectivity for the Inhibition of Cancer Cell Growth Generated by a Polymer Ligand of Proximal Enzymes.

A fundamental understanding of the design of polymer ligands of proximal enzymes is essential for the precise targeting of cancer cells, but it is still in its infancy. In this study, we systematically investigated the contribution of the chain length, ligand density, and ligand ratio of proximal enzyme-targeted polymers to the efficacy, synergy, and selectivity for the inhibition of cancer cell proliferation. The results revealed that employing a moderate chain length as a scaffold allowed for an intrinsically high efficacy and synergy of proximal enzyme-targeted polymers, in contrast to single enzyme-targeted polymers that prefer longer chain length for efficacy. The synergy obtained in proximal enzyme targeting was not provided by the combination of the corresponding small molecules. Moreover, the maturation of the synergistic efficacy of the proximal enzyme-targeted polymers also improved selectivity. This study proposes a rational design for polymer inhibitors and/or ligands for cancer cells with a high efficacy and selectivity.

Photoresponsive conductive polymer network based on azobenzene bridging crosslinked polycarbazole for boosting solar thermal storage

Azobenzene is one of the most extensively researched multifunctional chromophores and azobenzene including materials has a wide variety of applications due to their photoisomerization behavior. In this study, electroactive and light-harvesting carbazole and photoresponsive azobenzene units have been combined with a special macromolecular design. In this design the azo groups can be effectively isomerized in solid state, and free-standing films can be obtained by the electrochemical method. Thermal characterizations of both monomer and polymer have been performed and isomerization kinetics and solar-thermal properties have been investigated. The half-life at 60 °C and the gravimetric energy storage density of polymer was calculated as 103 min and 179.9 j g−1, respectively. Cross-linked polycarbazole structure causes dramatically increased solar thermal storage and half-life compared to respective monomer and brought unexpected mechanical and solvatochromic properties.

Fate and effects of an environmentally relevant mixture of microplastics in simple freshwater microcosms

Most studies assessing the effects of microplastics (MPs) on freshwater ecosystems use reference materials of a certain size, shape, and polymer type. However, in the environment, aquatic organisms are exposed to a mixture of different polymers with different sizes and shapes, resulting in different bioaccessible fractions and effects. This study assesses the fate and effects of an environmentally relevant mixture of high-density polyethylene (HDPE) fragments, polypropylene (PP) fragments, and polyester (PES) fibres in indoor freshwater microcosms over 28 days. The MP mixture contained common polymers found in freshwater ecosystems, had a size range between 50 and 3887 µm, and was artificially aged using a mercury lamp. The invertebrate species included in the microcosms, Lymnea stagnalis (snail) and Lumbriculus variegatus (worm), were exposed to four MP concentrations: 0.01, 0.05, 0.1 and 1 % of sediment dry weight. MPs fate was assessed by performing a balance of the MPs in the surface water, water column, and sediment after a stabilization period and at the end of the experiment. Sedimentation rates per day were calculated (2.13 % for PES, 1.46 % for HDPE, 1.87 % for PP). The maximum size of MPs taken up by the two species was determined and compared to the added mixture and their mouth size. The size range taken up by L. variegatus was smaller than L. stagnalis and significantly different from the size range in the added mixture. The No Observed Effect Concentrations (NOECs) for the reproduction factor of L. variegatus and the number of egg clutches produced by L. stagnalis were 0.01 % and 0.1 % sediment dry weight, respectively. The EC10 and EC50 for the same endpoint for L. stagnalis were 0.25 % and 0.52 %, respectively. This study shows that current MP exposure levels in freshwater sediments can result in sub-lethal effects on aquatic organisms, highlighting the importance of testing MP mixtures.

Characterization of Surface Patterning on Polymer-Grafted Nanocubes Using Atomic Force Microscopy and Force Volume Mapping.

Atomic force microscopy (AFM), in particular force spectroscopy, is a powerful tool for understanding the supramolecular structures associated with polymers grafted to surfaces, especially in regimes of low polymer density where different morphological structures are expected. In this study, we utilize force volume mapping to characterize the nanoscale surfaces of Ag nanocubes (AgNCs) grafted with a monolayer of polyethylene glycol (PEG) chains. Spatially resolved force-distance curves taken for a single AgNC were used to map surface properties, such as adhesion energy and deformation. We confirm the presence of surface octopus micelles that are localized on the corners of the AgNC, using force curves to resolve structural differences between the micelle "bodies" and "legs". Furthermore, we observe unique features of this system including a polymer corona stemming from AgNC-substrate interactions and polymer bridging stemming from particle-particle interactions.

Experimental studies on the interfacial shear characteristics between joint concrete and foamed polymer in cross-river shield tunnel

The inadequate grouting performance in cross-river shield tunnels is primarily due to the insufficient bonding strength between the grouting material and the tunnel segments. In this study, a series of tests were conducted to compare foamed polymer and common grouting materials, focusing on the tangential bonding performance of the interface with tunnel segment concrete under varying humidity conditions. The applicability of polymer for treating leaks in cross-river shield tunnels was explored. The effects of polymer density, interfacial humidity, interfacial roughness, and normal stress on the shear strength of the polymer-concrete interface were investigated. A mathematical model reflecting the interface shear characteristics between polymer and concrete was established and validated. The test results have shown that, due to the fast reaction speed and high expansion rate, foamed polymer was found to be a feasible solution for addressing leakage in cross-river shield tunnels. Compared with common grouting materials, the density of foamed polymer is controllable, and the shear strength between foamed polymer and concrete segments is less affected by humid conditions. The minimum shear strength of the interface between foamed polymer and concrete is 1.2 MPa, while the maximum is 2.0 MPa. Foamed polymer can meet the needs of leakage treatment of cross-river shield tunnel. The interfacial shear strength between foamed polymer and concrete segments is directly proportional to the polymer density, interfacial roughness, and normal stress, and inversely proportional to the level of humid in the tunnel. The influence of various factors on interfacial strength is ranked as follows: polymer density > interfacial humidity > normal pressure > interfacial roughness. The residual error of linear regression mathematical model for the shear strength of interface between foamed polymer and segment concrete follows a normal distribution. The fitting results were proven to be accurate, allowing for the intuitive prediction of the quantitative relationship between shear strength and multiple influencing factors.

Study on the Polymer Morphology and Electro-Optical Performance of Acrylate/Epoxy Resin-Based Polymer-Stabilized Liquid Crystals Based on Stepwise Photopolymerization.

Stepwise photopolymerization is a miraculous strategy modulating the polymer skeleton and electro-optical properties of light modulators based on liquid crystal/polymer composites. However, owing to the indistinct polymerization mechanism and curing condition discrepancy, the required polymer structures and electro-optical properties are hard to be controlled precisely. Herein, a novel polymer-stabilized liquid crystal film based on acrylate/epoxy resin is proposed, fabricated and the relationships between preparation process, polymer content, polymer morphology and electro-optical properties are studied. The in-situ photopolymerization of acrylate/epoxy resin liquid crystalline polymer is fulfilled using cation photo-initiator UV 6976. The distinct photopolymerization speed between acrylate and epoxy resin benefits the polymer morphology control, and with accurate containment of the polymerization process and polymer composition, the superior electro-optical properties at a higher polymer content are acquired. The polymer morphology and electro-optical properties are influenced by the polymer content and mass ratio between acrylate and epoxy resin. The best electro-optical properties among samples are attained by controlling the mass ratio between acrylate and epoxy resin to 1:1, integrating higher densities of scattering centers and lower anchoring effect. With higher polymer content, the strategy of increasing the mass ratio of E6M benefits the improvement of E-O properties for alleviating polymer density. This work provides insights to stepwise polymerization of liquid crystalline monomers and offers a fancy strategy for the preparation of novel liquid crystal dimming films.

Extracellular matrix regulation of cell spheroid invasion in a 3D bioprinted solid tumor-on-a-chip

Tumor organoids and tumors-on-chips can be built by placing patient-derived cells within an engineered extracellular matrix (ECM) for personalized medicine. The engineered ECM influences the tumor response, and understanding the ECM-tumor relationship accelerates translating tumors-on-chips into drug discovery and development. In this work, we tuned the physical and structural characteristics of ECM in a 3D bioprinted soft-tissue sarcoma microtissue. We formed cell spheroids at a controlled size and encapsulated them into our gelatin methacryloyl (GelMA)-based bioink to make perfusable hydrogel-based microfluidic chips. We then demonstrated the scalability and customization flexibility of our hydrogel-based chip via engineering tools. A multiscale physical and structural data analysis suggested a relationship between cell invasion response and bioink characteristics. Tumor cell invasive behavior and focal adhesion properties were observed in response to varying polymer network densities of the GelMA-based bioink. Immunostaining assays and reverse transcription-quantitative polymerase chain reaction (RT-qPCR) helped assess the bioactivity of the microtissue and measure the cell invasion. The RT-qPCR data showed higher expressions of HIF-1α, CD44, and MMP2 genes in a lower polymer density, highlighting the correlation between bioink structural porosity, ECM stiffness, and tumor spheroid response. This work is the first step in modeling STS tumor invasiveness in hydrogel-based microfluidic chips. Statement of significanceWe optimized an engineering protocol for making tumor spheroids at a controlled size, embedding spheroids into a gelatin-based matrix, and constructing a perfusable microfluidic device. A higher tumor invasion was observed in a low-stiffness matrix than a high-stiffness matrix. The physical characterizations revealed how the stiffness is controlled by the density of polymer chain networks and porosity. The biological assays revealed how the structural properties of the gelatin matrix and hypoxia in tumor progression impact cell invasion. This work can contribute to personalized medicine by making more effective, tailored cancer models.

Improving Environmental Stress Cracking Resistance of High-Density Polyethylene Grades by Comonomer Addition and Nanocomposite Approach.

The aim of this paper is to determine the effect of polymer density, correlated to the comonomer content, and nanosilica addition on the mechanical and Environmental Stress Cracking Resistance (ESCR) characteristics of high-density polyethylene (HDPE). In this regard, five HDPE samples with similar Melt Flow Index (MFI) and molar mass but various densities were acquired from a petrochemical plant. Two polymerization reactors work in series and differ only in the amount of 1-buene comonomer fed to the second reactor. To ascertain the microstructure of the studied samples, GPC and SSA (successive self-nucleation and annealing) analyses were accomplished. All samples resulted having similar characteristics but slightly various SCB/1000 C=7.26-9.74 (SCB=Short Chain Branching). Consequently, meanwhile studied HDPEs reveal similar notched impact and stress at yield values, the tensile modulus, stress-at-break, and elongation-at-break tend to demonstrate different results with the SCB content. More significantly, ESCR characteristic varied considerably with SCB/1000 C extent, so that higher amount of SCB acknowledged advanced ESCR. Notably, blending HDPE sample containing higher amount of SCB/1000 C, with 3 wt.% of chemically modified nanosilica enhanced ESCR characteristic by 40 %. DFT (Density Functional Theory) calculations unveiled the role of the comonomer, quantitatively by binding energies and qualitatively by Non Covalent Interaction (NCI) plots.

Concepts and Approaches to Reduce or Avoid Protein Corona Formation on Nanoparticles: Challenges and Opportunities.

This review describes the formation of a protein corona (or its absence) on different classes of nanoparticles, its basic principles, and its consequences for nanomedicine. For this purpose, it describes general concepts to control (guide/minimize) the interaction between artificial nanoparticles and plasma proteins to reduce protein corona formation. Thereafter, methods for the qualitative or quantitative determination of protein corona formation are presented, as well as the properties of nanoparticle surfaces, which are relevant for protein corona prevention (or formation). Thereby especially the role of grafting density of hydrophilic polymers on the surface of the nanoparticle is discussed to prevent the formation of a protein corona. In this context also the potential of detergents (surfactants) for a temporary modification as well as grafting-to and grafting-from approaches for a permanent modification of the surface are discussed. The review concludes by highlighting several promising avenues. This includes (i) the use of nanoparticles without protein corona for active targeting, (ii) the use of synthetic nanoparticles without protein corona formation to address the immune system, (iii) the recollection of nanoparticles with a defined protein corona after in vivo application to sample the blood proteome and (iv) further concepts to reduce protein corona formation.

Influence of NiCo2O4/PbS nanocomposite on the structural, optical and electrical properties of Polymethyl Methacrylate polymer

Poly(methyl methacrylate) (PMMA)/(1-x)NiCo2O4/xPbS polymers were prepared using the casting hydrothermal and solid state reaction methods. The different phases formed in (1-x)NiCo2O4/xPbS nanocomposites were determined using the X-ray diffraction (XRD) technique. XRD and scanning electron microscopy (SEM) techniques were used to explore the structure and morphology of the formed polymers. The influence of (1-x)NiCo2O4/xPbS nanocomposite doping on the absorption, transmission, extinction coefficient, absorption coefficient, refractive index, nonlinear optical parameters and fluorescence spectra of PMMA polymer was explored using diffused reflectance and fluorescence spectrophotometer techniques. The direct and indirect optical band gap (Eg) values decreased from (5.31 and 5.06) eV (for undoped PMMA) to (4.66 and 4.17) eV (for doped PMMA with x = 0.1 filler), respectively. Several models based on the Eg value were used to find out the value of the refractive index of different polymers. The impact of doping on the dielectric constant, relaxation time, energy density, electrical conductivity and electric modulus of the PMMA polymer was also studied using an LCR meter.

Enhancing colloidal stability of nanodiamond via surface modification with dendritic molecules for optical sensing in physiological environments

Pre-treatment of diamond surface in low-temperature plasma for oxygenation and in acids for carboxylation was hypothesized to promote the branching density of the hyperbranched glycidol polymer. This was expected to increase the homogeneity of the branching level and suppress interactions with proteins. As a result, composite nanodiamonds with reduced hydrodynamic diameters that are maintained in physiological environments were anticipated. Surfaces of 140-nm-sized nanodiamonds were functionalized with oxygen and carboxyl groups for grafting of hyperbranched dendritic polyglycerol via anionic ring-opening polymerization of glycidol. The modification was verified with Fourier-transform infrared spectroscopy and X-ray photoelectron spectroscopy. Dynamic light scattering investigated colloidal stability in pH-diverse (2–12) solutions, concentrated phosphate-buffered saline, and cell culture media. Thermogravimetric analysis of nanodiamonds-protein incubations examined non-specific binding. Fluorescence emission was tested across pH conditions. Molecular dynamics simulations modeled interparticle interactions in ionic solutions. The hyperbranched polyglycerol grafting increased colloidal stability of nanodiamonds across diverse pH, high ionic media like 10 × concentrated phosphate-buffered saline, and physiological media like serum and cell culture medium. The hyperbranched polyglycerol suppressed non-specific protein adsorption while maintaining intensive fluorescence of nanodiamonds regardless of pH. Molecular modelling indicated reduced interparticle interactions in ionic solutions correlating with the improved colloidal stability.

Diffusion of curcumin in PLGA-based carriers for drug delivery: a molecular dynamics study

Context:The rapid growth and diversification of drug delivery systems have been significantly supported by advancements in micro- and nano-technologies, alongside the adoption of biodegradable polymeric materials like poly(lactic-co-glycolic acid) (PLGA) as microcarriers. These developments aim to reduce toxicity and enhance target specificity in drug delivery. The use of in silico methods, particularly molecular dynamics (MD) simulations, has emerged as a pivotal tool for predicting the dynamics of species within these systems. This approach aids in investigating drug delivery mechanisms, thereby reducing the costs associated with design and prototyping. In this study, we focus on elucidating the diffusion mechanisms in curcumin-loaded PLGA particles, which are critical for optimizing drug release and efficacy in therapeutic applications.Methods:We utilized MD to explore the diffusion behavior of curcumin in PLGA drug delivery systems. The simulations, executed with GROMACS, modeled curcumin molecules in a representative volume element of PLGA chains and water, referencing molecular structures from the Protein Data Bank and employing the CHARMM force field. We generated PLGA chains of varying lengths using the Polymer Modeler tool and arranged them in a bulk-like environment with Packmol. The simulation protocol included steps for energy minimization, T and p equilibration, and calculation of the isotropic diffusion coefficient from the mean square displacement. The Taguchi method was applied to assess the effects of hydration level, PLGA chain length, and density on diffusion.Results:Our results provide insight into the influence of PLGA chain length, hydration level, and polymer density on the diffusion coefficient of curcumin, offering a mechanistic understanding for the design of efficient drug delivery systems. The sensitivity analysis obtained through the Taguchi method identified hydration level and PLGA density as the most significant input parameters affecting curcumin diffusion, while the effect of PLGA chain length was negligible within the simulated range. We provided a regression equation capable to accurately fit MD results. The regression equation suggests that increases in hydration level and PLGA density result in a decrease in the diffusion coefficient.

Decoding thermal properties in polymer-inorganic heat dissipators: a data-driven approach using pyrolysis mass spectrometry

ABSTRACT Polymeric materials can boost their performances by strategically incorporating inorganic substances. Heat dissipators are a representative class of such composite materials, where inorganic fillers and matrix polymers contribute to high thermal conductivity and strong adhesion, respectively, resulting in excellent heat dissipation performance. However, due to the complex interaction between fillers and polymers, even slight differences in structural parameters, e.g. dispersion/aggregation degree of fillers and crosslink density of polymers, may significantly impact material performance, complicating the quality management and guidelines for material developments. Therefore, we introduce pyrolysis mass spectra (MS) as material descriptors. On the basis of these spectra, we construct prediction models using a data-driven approach, specifically focusing on thermal conductivity and adhesion, which are key indicators for heat dissipating performance. Pyrolysis-MS observes thermally decomposable polymers, which occupy only 0.1 volume fraction of the heat dissipators; nevertheless, the physical states of non-decomposable inorganic fillers are implicitly reflected in the pyrolyzed fragment patterns of the matrix polymers. Consequently, pyrolysis-MS provides sufficient information to construct accurate models for predicting heat dissipation performance, simplifying quality management by substituting time-consuming performance evaluations with rapid pyrolysis-MS measurements. Furthermore, we elucidate that higher crosslinking density of the matrix polymers enhances thermal conductivity. This data-driven method promises to streamline the identification of key functional factors in complex composite materials.

Selective localization of carbonized polymer dots in amorphous phase towards high breakdown strength and energy density of PVDF-based dielectric composites

In a general way, there is a contradictory between dielectric constant (εr) and breakdown strength (Eb) in dielectric materials, and improving the discharge energy density (Ud) of dielectric polymers has become a great challenge. The semicrystalline ferroelectric polymer polyvinylidene fluoride (PVDF) is favored for its high εr, but its relatively weak Eb in amorphous regions makes it still difficult to obtain appreciable Ud. In response to the fact that the current method of introducing rigid chain amorphous polymers into the amorphous regions of PVDF has limited capability to enhance its Eb, in this work, due to the crystallization induced phase separation, carbonated polymer dots (CPDs) as well as PMMA were introduced into the amorphous region of PVDF, and CPDs/PVDF/PMMA composites were prepared towards high Eb and Ud. It is confirmed that, CPDs significantly increase the entanglement density of molecular chains in amorphous regions of PVDF; in addition, CPDs rely on their inorganic carbon cores with unique electrical properties to resist carrier migration in amorphous regions of PVDF under high electric fields. In brief, CPDs are used as a reinforcing agent for the amorphous region of PVDF to further enhance its Eb and Ud. The composite loaded with 0.1 wt% CPDs exhibits the superior Ud of 12.4 J/cm3 at the Eb of 652.0 MV/m. This work provides new understanding on the dielectric response of ultrasmall-sized CPDs on polymer dielectrics, which could help us design new dielectric polymer composites with suppressed segmental motions for high breakdown strength and high energy density applications.

Phase behavior of ionic fluid in charged confinement: An associating polymer density functional theory study

AbstractWith the rapid advancement of the new energy industry, porous electrode materials and complex electrolytes have gained widespread usage. Electrolytes exhibit distinctive phase behavior when subjected to the combined influence of confined space and electric fields. However, the measurement and prediction of such phase behavior encounter significant challenges. Consequently, numerous theoretical tools have been employed to establish models for phase equilibrium calculations. Nevertheless, current research in this field has notable limitations and fails to address the confinement of space or complex polymer electrolytes. Considering these shortcomings, an associating polymer density functional theory (PDFT) was developed by modifying excess free energy. This study examines the phase behavior of electrolytes with various chain lengths within diverse confined slits, revealing that the confinement effect and fluid tail chains can narrow the phase diagram. Additionally, a linear correlation between the electric field strength and the phase equilibrium offset has been identified, and a quantitative relationship is derived. The results of this investigation contribute to a deeper comprehension of complex fluid phase behavior and guide the design of electrochemical devices.

High-temperature dielectric with excellent capacitive performance enabled by rationally designed traps in blends

Polymer dielectrics with excellent capacitive performance are urgently needed in advanced electrical and electronic systems. However, due to the dramatic increase in the conduction loss, the energy density and efficiency of polymers degrade severely at elevated temperatures, limiting their application in harsh environments up to 150 °C. Herein, an all-organic polyurea (PU)/polyetherimide (PEI) blend film is designed to prepare high-temperature polymer dielectric. It is found that carrier traps can be introduced by blending, and the hydrogen bond between PU and PEI increases the trap depth, leading to suppressed leakage current and enhanced breakdown strength, thus improving the energy storage performance. PU/30%PEI exhibits a high discharged energy density of ∼3.74 J/cm3 with an efficiency higher than 90% at 150 °C, which is 78% and 70% higher than pristine PU and PEI, respectively. This work provides a facile strategy to improve the energy storage performance of polymer dielectrics by introducing deep traps through blending.

Analyzing Impact Strength Improvement in Polymer Laminates: A Comparative Study of Machine Direction Oriented (MDO)-PE/LLDPE and Polyamide (PA)/LLDPE Structures

The mechanical strength of 2 film structures, machine-direction-oriented polyethylene (MDO-PE) laminated with linear low-density polyethylene (LLDPE) and polyamide (PA) laminated with LLDPE was evaluated. PA/LLDPE films demonstrated superior impact strength (0.834 J/mm²) compared to MDO-PE/LLDPE films (0.445 J/mm²). Tensile strength for modified LLDPE (C₆) was 40 N/mm², higher than standard LLDPE (C₈) at 33 N/mm². The elongation at break for LLDPE reference C₈ was 689 %, compared to 682 % for LLDPE sample C₆. Film stiffness was measured at 162 MPa for the LLDPE reference C₈ and 122 MPa for the LLDPE sample C₆. PA films exhibited increased mechanical strength due to their intrinsic polyamide structure, while MDO-PE films benefited from molecular orientation during production. The modified LLDPE or C₆ displayed improved impact resistance and tensile strength with reduced stiffness. MDO-PE/LLDPE films are promising for sustainable and robust food packaging. HIGHLIGHTS Comparative Mechanical Strength of Films: Polyamide (PA) films, owing to their chemical structure rich in amide groups, exhibit superior mechanical strength compared to machine direction-oriented polyethylene (MDO-PE) films. Peeling Strength Dynamics: PA/LLDPE laminates display greater initial peeling strength; however, MDO-PE/LLDPE laminates show a gradual increase in peeling strength, indicating potential for improved long-term adhesion. Impact of LLDPE Density on Mechanical Properties: A comparison between LLDPE C₈ and LLDPE C₆ highlights the influence of polymer density on mechanical characteristics, with LLDPE C₆ demonstrating enhanced impact and tensile strengths at the expense of modulus and elongation. Strength Variability Among Laminates: The mechanical properties of laminated films are significantly influenced by the nature of their constituent layers, revealing the complexity of integrating polymers with differing characteristics. Potential of MDO-PE/LLDPE Laminates: Despite the superior properties of PA/LLDPE laminates, MDO-PE/LLDPE emerges as a viable alternative for sustainable and cost-effective packaging solutions, necessitating further validation to fully harness its advantages. GRAPHICAL ABSTRACT

Machine-Learning-Aided Understanding of Protein Adsorption on Zwitterionic Polymer Brushes.

Constructing antifouling surfaces is a crucial technique for optimizing the performance of devices such as water treatment membranes and medical devices in practical environments. These surfaces are achieved by modification with hydrophilic polymers. Notably, zwitterionic (ZI) polymers have attracted considerable interest because of their ability to form a robust hydration layer and inhibit the adsorption of foulants. However, the importance of the molecular weight and density of the ZI polymer on the antifouling property is partially understood, and the surface design still retains an empirical flavor. Herein, we individually assessed the influence of the molecular weight and density of the ZI polymer on protein adsorption through machine learning. The results corroborated that protein adsorption is more strongly influenced by density than by molecular weight. Furthermore, the distribution of predicted protein adsorption against molecular weight and polymer density enabled us to determine conditions that enhanced (or weaken) antifouling. The relevance of this prediction method was also demonstrated by estimating the protein adsorption over a wide range of ionic strengths. Overall, this machine-learning-based approach is expected to contribute as a tool for the optimized functionalization of materials, extending beyond the applications of ZI polymer brushes.

A two-phase thin-film model for cell-induced gel contraction incorporating osmotic effects

We present a mathematical model of an experiment in which cells are cultured within a gel, which in turn floats freely within a liquid nutrient medium. Traction forces exerted by the cells on the gel cause it to contract over time, giving a measure of the strength of these forces. Building upon our previous work (Reoch et al. in J Math Biol 84(5):31, 2022), we exploit the fact that the gels used frequently have a thin geometry to obtain a reduced model for the behaviour of a thin, two-dimensional cell-seeded gel. We find that steady-state solutions of the reduced model require the cell density and volume fraction of polymer in the gel to be spatially uniform, while the gel height may vary spatially. If we further assume that all three of these variables are initially spatially uniform, this continues for all time and the thin film model can be further reduced to solving a single, non-linear ODE for gel height as a function of time. The thin film model is further investigated for both spatially-uniform and varying initial conditions, using a combination of analytical techniques and numerical simulations. We show that a number of qualitatively different behaviours are possible, depending on the composition of the gel (i.e., the chemical potentials) and the strength of the cell traction forces. However, unlike in the earlier one-dimensional model, we do not observe cases where the gel oscillates between swelling and contraction. For the case of initially uniform cell and gel density, our model predicts that the relative change in the gels’ height and length are equal, which justifies an assumption previously used in the work of Stevenson et al. (Biophys J 99(1):19–28, 2010). Conversely, however, even for non-uniform initial conditions, we do not observe cases where the length of the gel changes whilst its height remains constant, which have been reported in another model of osmotic swelling by Trinschek et al. (AIMS Mater Sci 3(3):1138–1159, 2016; Phys Rev Lett 119:078003, 2017).