Tooth instance segmentation from cone-beam CT images through point-based detection and Gaussian disentanglement

Multimedia Tools and Applications - Individual tooth segmentation and identification from cone-beam computed tomography images are preoperative prerequisites for orthodontic treatments. Instance...     

Structural insights into peptide self-assembly using photo-induced crosslinking experiments and discontinuous molecular dynamics

Determining the structure of the (oligomeric) intermediates that form during the self-assembly of amyloidogenic peptides is challenging because of their heterogeneous and dynamic nature. Thus, there is need for methodology to analyze the underlying molecular structure of these transient species. In this work, a combination of fluorescence quenching, photo-induced crosslinking (PIC) and molecular dynamics simulation was used to study the assembly of a synthetic amyloid-forming peptide, Aβ_16-22. A PIC amino acid containing a trifluormethyldiazirine (TFMD) group—Fmoc(TFMD)Phe—was incorporated into the sequence (Aβ*_16–22). Electrospray ionization ion-mobility spectrometry mass-spectrometry (ESI-IMS-MS) analysis of the PIC products confirmed that Aβ*_16–22 forms assemblies with the monomers arranged as anti-parallel, in-register β-strands at all time points during the aggregation assay. The assembly process was also monitored separately using fluorescence quenching to profile the fibril assembly reaction. The molecular picture resulting from discontinuous molecule dynamics simulations showed that Aβ_16-22 assembles through a single-step nucleation into a β-sheet fibril in agreement with these experimental observations. This study provides detailed structural insights into the Aβ_16-22 self-assembly processes, paving the way to explore the self-assembly mechanism of larger, more complex peptides, including those whose aggregation is responsible for human disease.     

Revealing Nanomechanical Domains and Their Transient Behavior in Mixed-Halide Perovskite Films

Halide perovskites are a versatile class of semiconductors employed for high performance emerging optoelectronic devices, including flexoelectric systems, yet the influence of their ionic nature on their mechanical behavior is still to be understood. Here, a combination of atomic-force, optical, and compositional X-ray microscopy techniques is employed to shed light on the mechanical properties of halide perovskite films at the nanoscale. Mechanical domains within and between morphological grains, enclosed by mechanical boundaries of higher Young's Modulus (YM) than the bulk parent material, are revealed. These mechanical boundaries are associated with the presence of bromide-rich clusters as visualized by nano-X-ray fluorescence mapping. Stiffer regions are specifically selectively modified upon light soaking the sample, resulting in an overall homogenization of the mechanical properties toward the bulk YM. This behavior is attributed to light-induced ion migration processes that homogenize the local chemical distribution, which is accompanied by photobrightening of the photoluminescence within the same region. This work highlights critical links between mechanical, chemical, and optoelectronic characteristics in this family of perovskites, and demonstrates the potential of combinational imaging studies to understand and design halide perovskite films for emerging applications such as photoflexoelectricity.     

Borage Oil Enhances Lamellar Body Content and Alters Fatty Acid Composition of Epidermal Ceramides in Essential Fatty Acid-Deficient Guinea Pigs

Borage oil [BO: 40.9% linoleic acid (LNA) and 24.0% γ-linolenic acid (GLA)] reverses disrupted epidermal lipid barrier in essential fatty acid deficiency (EFAD). We determined the effects of BO on lamellar body (LB) content and LNA and GLA incorporation into epidermal ceramide 1 (CER1) and epidermal ceramide 2 (CER2), major barrier lipids. EFAD was induced in guinea pigs by a diet of 6% hydrogenated coconut oil (HCO) for 10 weeks (group HCO) or 8 weeks followed by 6% BO for 2 weeks (group HCO + BO). LB content and LNA and GLA incorporation into CER1 were higher in group HCO + BO than in group HCO. Small but significant levels of LNA, GLA, and their C20-metabolized fatty acids [dihomo-γ-linolenic acid (DGLA) and arachidonic acid (ARA)] were incorporated into CER2, where ARA was detected at a level lower than LNA, but DGLA incorporation exceeded that for GLA in group HCO + BO. Dietary BO enhanced LB content and differential incorporation of GLA into CER1 and DGLA into CER2.     

Implication of Size-Controlled Graphite Nanosheets as Building Blocks for Thermal Conductive Three-Dimensional Framework Architecture of Nanocarbons

Preparation of three-dimensional (3D) networks has received significant attention as an effective approach for applications involving transport phenomena, such as thermal management materials, and several nanomaterials have been examined as potential building blocks of 3D networks for the improvement of heat conduction in polymer nanocomposites. For that purpose, nanocarbons such as graphene and graphite nanoplatelets have been spotlighted as suitable filler materials because of their excellent thermal conductivities (ca. 10²–10³ W·(m·K)^?1 along their lateral axes) and morphological merits. However, the implications of morphological features such as the lateral length and thickness of graphene or graphene-like materials have not yet been identified. In this study, a controlled dissociation of bulk graphite to graphite nanosheets (GNSs) using a low-cost, ecofriendly bead mill process was extensively examined and, when configured in a 3D framework architecture formation, the size-controlled GNSs demonstrated that the thermal conductivities of a 3D interconnected framework of GNSs and the corresponding polymer nanocomposite were intimately correlated with the size of the GNSs, thus demonstrating the successful preparation of an efficient thermal management material without highly sophisticated efforts. The capability of controlling the lateral size and thickness of the GNSs as well as the use of a 3D interconnected framework architecture should greatly assist the commercialization of high-quality graphene-based thermal management materials in a scalable production process.     

Carbon Cathode Wear in Aluminium Electrolysis Cells

JOM - Autopsies of six spent potlinings with different carbon cathode block grades, amperage regimes and cell designs were conducted at three separate smelters to reveal possible mechanisms causing...     

Activity-Directed Synthesis: A Flexible Approach for Lead Generation

Activity-directed synthesis (ADS) is a structure-blind, functional-driven molecular discovery approach. In this Concept, four case studies highlight the general applicability of ADS and showcase its flexibility to support different medicinal chemistry strategies. ADS deliberately harnesses reactions with multiple possible outcomes, and allows many chemotypes to be evaluated in parallel. Resources are focused on bioactive molecules, which emerge in tandem with associated synthetic routes. Some of the future challenges for ADS are highlighted, including the realisation of an autonomous molecular discovery platform. The prospects for ADS to become a mainstream lead generation approach are discussed.     

Systematic literature review on city logistics: overview,classification and analysis

City logistics is one of the significant branches of supply chain management, dealing with the logistics and transportation activities in urban areas. This research area has recently appropriated an exponential growth of publications. This paper presents a bibliometric analysis along with a systematic literature review to organise the results of surveying more than 370 papers and research works published since 2010. We identify the top contributing research topics. The most common keywords used in the city logistics literature are referred to in order to propose six research categories identifying the main innovative research perspectives.     

Understanding structure ignition vulnerabilities using mock‐up sections of attached wood fencing assemblies

Firebrand production from structure combustion becomes a key factor in the magnitude of how quickly a large outdoor fire may spread. Post‐fire disaster investigations suggest that attached building components, such as wood fencing assemblies are known to be prone to ignition in these fires, and may provide pathways to structure ignition. Here, a comparison of ignition results from full‐scale fencing assembly experiments conducted using a full‐scale wind tunnel facility, to mock‐ups of full‐scale fencing assemblies using the recently developed experimental capability at the National Research Institute of Fire and Disaster (NRIFD) are discussed. In both experimental facilities, the fencing assemblies were exposed to firebrand showers using custom built continuous feed firebrand generators with size and mass distributions similar to those generated from structure combustion. Similar ignition behaviors were observed between the full‐scale fencing assemblies and the mock‐up of full‐scale fencing assemblies. Additional experiments are required for other fencing assembly types to further verify these important findings.