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0038 mm/min was still slower than that of the nanosphere clusters. Such observations were mainly a result of the packing density differences between the formed clusters; due to the end-to-end particle interactions of nanorods, the nanorod clusters were less tightly packed and more permeable. In addition to the mathematical analysis, quartz crystal microbalance with dissipation (QCM-D) was employed to measure the "softness" of the IONP clusters formed, and this physical property can be further related to their packing density. This study illustrated that for a rapidly aggregating system, such as magnetic IONPs, not only do the particle shape and size uniformity contribute to the physical properties of the particle clusters formed but also the nature of the aggregation, either end-to-end and/or side-to-side, should be carefully considered when designing a colloidally stable IONP suspension.Protein-protein interactions play a major role in the molecular machinery of life, and various techniques such as AP-MS are dedicated to their identification. However, those techniques return lists of proteins devoid of organizational structure, not detailing which proteins interact with which others. Proposing a hierarchical view of the interactions between the members of the flat list becomes highly tedious for large data sets when done by hand. To help hierarchize this data, we introduce a new bioinformatics protocol that integrates information of the multimeric protein 3D structures available in the Protein Data Bank using remote homology detection, as well as information related to Short Linear Motifs and interaction data from the BioGRID. We illustrate on two unrelated use-cases of different complexity how our approach can be useful to decipher the network of interactions hidden in the list of input proteins, and how it provides added value compared to state-of-the-art resources such as Interactome3D or STRING. Particularly, we show the added value of using homology detection to distinguish between orthologs and paralogs, and to distinguish between core obligate and more facultative interactions. We also demonstrate the potential of considering interactions occurring through Short Linear Motifs.The photothermal transduction efficiencies of group 4 metal nitrides, TiN, ZrN, and HfN, at λ = 850 nm are reported, and the performance of these materials is compared to an Au nanorod benchmark. Transition metal nitride nanocrystals with an average diameter of ∼15 nm were prepared using a solid-state metathesis reaction. HfN exhibited the highest photothermal transduction efficiency of 65%, followed by ZrN (58%) and TiN (49%), which were all higher than those of the commercially purchased Au nanorods (43%). Computational studies performed using a finite element method showed HfN and Au to have the lowest and highest scattering cross section, respectively, which could be a contributing factor to the efficiency trends observed. Furthermore, the changes in temperature as a function of illumination intensity and solution concentration, as well as the cycling stability of the metal nitride solutions, were studied in detail.In the present work, the dimethyl carbonate (DMC)-methanol binary mixture was used as a benchmark system to study the molecular structures of the liquid/vapor interface of organic-organic mixtures by sum frequency generation vibrational spectroscopy (SFG-VS) and molecular dynamics (MD) simulations. It was discovered that both the methanol and DMC molecules are anisotropically oriented at the surface, yielding strong SFG-VS signals in the C-H stretching frequency range for both molecules. The detailed analyses of the spectroscopic and MD data reveal that the increase of the methanol bulk concentrations reduces the orientational order of the methyl groups for both the interfacial DMC and methanol molecules but does not significantly affect the orientations of the carbonyl group in DMC. https://www.selleckchem.com/products/pf-06821497.html Moreover, no obvious correlations were found between the room-temperature orientations of the surface molecules and the azeotropic mole fraction. The present work paves the road for future investigations on the molecular structures of the liquid/vapor interfaces of other organic-organic mixtures, especially those that are important in industrial separations.Knowledge of atomistic structures at solid/liquid interfaces is essential to elucidate interfacial processes in chemistry, physics, and materials sciences. The (√3 × √7) structure associated with a pair of sharp reversible current spikes in the cyclic voltammogram on a Au(111) electrode in sulfuric acid solution represents one of the most classical ordered structures at electrode/electrolyte interfaces. Although more than 10 adsorption configurations have been proposed in the past four decades, the atomistic structure remains ambiguous and is consequently an open problem in electrochemistry and surface science. Herein, by combining high-resolution electrochemical scanning tuning microscopy, electrochemical infrared and Raman spectroscopies, and, in particular, the newly developed quantitative computational method for electrochemical infrared and Raman spectra, we unambiguously reveal that the adstructure is Au(111)(√3 × √7)-(SO4···w2) with a sulfate anion (SO4*) and two structured water molecules (w2*) in a unit cell, and the crisscrossed [w···SO4···w]n and [w···w···]n hydrogen-bonding network comprises the symmetric adstructure. We further elucidate that the electrostatic potential energy dictates the proton affinity of sulfate anions, leading to the potential-tuned structural transformations. Our work enlightens the structural details of the inner Helmholtz plane and thus advances our fundamental understanding of the processes at electrochemical interfaces.In this study, a Petri-dish-based double-layer high-throughput screening method was established to improve glucose tolerance of β-glucosidase Bgl15. Two beneficial mutations were identified, and the joint mutant 2R1 improved the half-maximal inhibitory concentration of glucose from 0.04 to 2.1 M. The crystal structure of 2R1 was subsequently determined at 2.7 Å. Structure analysis revealed that enhancement of glucose tolerance may be due to improved transglycosylation activity made possible by a hydrophobic binding site for glucose as an acceptor and more stringent control of a putative water channel. To further ameliorate the application potential of the enzyme, it was engineered to increase the half-life at 50 °C from 0.8 h (Bgl15) to 180 h (mutant 5R1). Furthermore, supplementation of 5R1 to the cellulase cocktail significantly improved glucose production from pretreated sugar cane bagasse by 38%. Consequently, this study provided an efficient approach to enhance glucose tolerance and generated a promising catalyst for cellulose saccharification.