To better understand the role of surface chemical heterogeneity in natural nanoscale hydration, we study via molecular dynamics simulation the structure and thermodynamics of water confined between two protein-like surfaces. Each surface is constructed to have interactions with water corresponding to those of the putative hydrophobic surface of a melittin dimer, but is flattened rather than hav...

We calculate the ion distributions around an interface in fluid mixtures of highly polar and less polar fluids (water and oil) for two and three ion species. We take into account the solvation and image interactions between ions and solvent. We show that hydrophilic and hydrophobic ions tend to undergo a microphase separation at an interface, giving rise to an enlarged electric double layer. We...

Inorganic colloidal nanoparticles (NPs) stabilized by a layer of hydrophobic surfactant on their surfaces have poor solubility in the aqueous phase, thus limiting their application as biosensors under physiological conditions. Here we report a simple model to ionize various types of hydrophobic colloidal NPs, including FePt, cubic Fe3O4, Pd, CdSe, and NaYF4 (Yb 30%, Er 2%, Nd 1%) NPs, to multic...

Unspecific adhesion of bacteria is usually the first step in the formation of biofilms on abiotic surfaces, yet it is unclear up to now which forces are governing this process. Alongside long-ranged van der Waals and electrostatic forces, short-ranged hydrophobic interaction plays an important role. To characterize the forces involved during approach and retraction of an individual bacterium to...

One of the most common and important interfaces is the boundary layer between an aqueous phase solution of ions and a hydrophobic medium. Whether the hydrophobic medium is a membrane, a macromolecular assembly, or a simple organic liquid, our molecular-level understanding of how ions in an adjacent aqueous phase approach, alter, and transport across the boundary is still quite deficient, largel...

Flavonoids are a group of plant secondary metabolites including polyphenolic molecules, and they are well known for antioxidant, anti-allergic, anti-inflammatory and anti-viral propertied. In general, flavonoids are detected with various non-colorimetric detection methods such as column liquid chromatography, thin-layer chromatography, and electrochemical analysis. For the first time, we develo...

Hydrophilic and hydrophobic weak polybasic brushes immersed in aqueous solutions of mixed salt counterions are considered using a mean-field numerical self-consistent field approach. On top of the solvent quality of the polymer, the counterion-solvent interactions are accounted for by implementing Flory-Huggins interaction parameters. We show that ion specificity within the brush can bring abou...

MRG15 is a transcription factor expressed in a variety of human tissues, and its orthologs have been found in many other eukaryotes which constitute the MRG protein family. It plays a vital role in embryonic development and cell proliferation, and is involved in cellular senescence. The C-terminal part of MRG15 forms a conserved MRG domain which is involved in interactions with the tumor suppre...

Membranes are of increasing interest for the removal of human enteric viruses from wastewater, especially when the goal of treatment is reuse. Limited work has been undertaken on fundamental issues such as aggregation and the role of electrostatic and hydrophobic interactions, as opposed to the sieving of viruses by membranes. One apparently critical factor would be the iso-electric point (pI) ...

In this article, liquid moisture transport behaviors of dual-layer electrospun nanofibrous mats are reported for the first time. The dual-layer mats consist of a thick layer of hydrophilic polyacrylonitrile (PAN) nanofibers with a thin layer of hydrophobic polystyrene (PS) nanofibers with and without interpenetrating nanopores, respectively. The mats are coated with polydopamine (PDOPA) to diff...