Host-guest interfacial recognition of alginate-based β-cyclodextrin/dendrobine supra-amphiphiles reinforced the physicochemical stability and sustained-release properties of Pickering emulsions.

Achieving high bioavailability of dendrobine (DDB) necessitates the development of simplified available and efficient delivery systems. Pickering emulsions (PEs) derived from biomass represent a promising option. However, the physicochemical properties of PEs interfacial films were insufficient to prevent DDB leakage, thereby reducing bioavailability.

PN Codes Estimation of Binary Phase Shift Keying Signal Based on Sparse Recovery for Radar Jammer.

Parameter estimation is extremely important for a radar jammer. With binary phase shift keying (BPSK) signals widely applied in radar systems, estimating the parameters of BPSK signals has attracted increasing attention. However, the BPSK signal is difficult to be processed by traditional time frequency analysis methods due to its phase jumping and abrupt discontinuity features which makes it difficult to extract PN (PN) codes of the BPSK signal.

Necroptosis signaling and NLRP3 inflammasome cross-talking in epithelium facilitate Pseudomonas aeruginosa mediated lung injury.

Pseudomonas aeruginosa induced acute lung injury is such a serious risk to public health, but the pathological regulation remains unclear. Here, we reported that PA mediated epithelial necroptosis plays an important role in pathological process. Pharmacological and genomic ablation of necroptosis signaling ameliorate PA mediated ALI and pulmonary inflammation.

DDR1 activation in macrophage promotes IPF by regulating NLRP3 inflammasome and macrophage reaction.

Background: Discoidin Domain Receptor1 (DDR1) is a member of receptor tyrosine kinases (RTKs) which have been reported to be associated with idiopathic pulmonary fibrosis (IPF), but the mechanism remains unclear.

Methods: Bleomycin-induced IPF mice model was performed in this study, and two DDR1 inhibitors were administered in vivo, to investigate the role of DDR1 in IPF. Lentivirus mediated DDR1 stable Raw264.

Synthesis, Simulation, and Self-Assembly of a Model Amphiphile To Push the Limits of Block Polymer Nanopatterning.

Efforts to create block-polymer-based templates with ultrasmall domain sizes has stimulated integrated experimental and theoretical work in an effort to design and prepare self-assembled systems that can achieve unprecedented domain sizes. We recently reported the utilization of molecular dynamics simulations with transferable force fields to identify amphiphilic oligomers capable of self-assembling into ordered layered and cylindrical morphologies with sub-3 nm domain sizes. Motivated by these predictions, we prepared a sugar-based amphiphile with a hydrocarbon tail that shows thermotropic self-assembly to give a lamellar mesophase with a 3.

Renewable lubricants with tailored molecular architecture.

We present a strategy to synthesize three types of renewable lubricant base oils with up to 90% yield using 2-alkylfurans, derived from nonfood biomass, and aldehydes, produced from natural oils or biomass through three chemistries: hydroxyalkylation/alkylation (HAA), HAA followed by hydrogenation, and HAA followed by hydrodeoxygenation. These molecules consist of (i) furan rings, (ii) saturated furan rings, and (iii) deoxygenated branched alkanes. The structures of these molecules can be tailored in terms of carbon number, branching length, distance between branches, and functional groups.

Using molecular simulations to probe pore structures and polymer partitioning in size exclusion chromatography.

Molecular simulations have been extensively utilized to understand and predict the polymer partitioning in size-exclusion chromatography (SEC). However, idealized pore models (e.g.

Computational Design of High-χ Block Oligomers for Accessing 1 nm Domains.

Molecular dynamics simulations are used to design a series of high-χ block oligomers (HCBOs) that can self-assemble into a variety of mesophases with domain sizes as small as 1 nm. The exploration of these oligomers with various chain lengths, volume fractions, and chain architectures at multiple temperatures reveals the presence of ordered lamellae, perforated lamellae, and hexagonally packed cylinders. The achieved periods are as small as 3.

Using the k-d Tree Data Structure to Accelerate Monte Carlo Simulations.

The k-d tree data structure is implemented in a Monte Carlo (MC) molecular simulation program to accelerate the range search for particles or interaction sites within the cutoff distance when Lennard-Jones and Coulomb interactions are computed. MC simulations are performed for different molecules in various ensembles to assess the efficiency enhancements due to the k-d tree data structure. It is found that the use of k-d trees accelerates significantly simulations for Lennard-Jones particles in the NVT and NVT-Gibbs ensembles and for n-butane and 2,4,6,8,10,12,14,16,18,20,22-undecamethylpentacosane represented by the TraPPE-UA force field in the NpT ensemble.

Electrokinetic desalination using honeycomb carbon nanotubes (HC-CNTs): a conceptual study by molecular simulation.

A new concept of electrokinetic desalination using a CNT honeycomb is presented through molecular dynamics simulation. The preferential translocation of ions towards the outlets near two electrodes was realized by applying an electric field perpendicular to bulk fluid flow in a CNT network, which, in the meantime, generated deionized water flux discharged from the central outlets. The effects of the major factors such as electric field strength, numbers of separation units, diameter of CNT, and ion concentration on the desalination were examined.

Controlled display of enzyme activity with a stretchable hydrogel.

An enzyme-incorporated hydrogel made of alginate and polyacrylamide shows a linearly increased activity with the enlargement of surface area upon stretching.