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Metal-ion doping and halogen substitution have been largely applied to tune the bandgap of bismuth oxybromide (BiOBr) to upgrade its photodegradation capacity. In this work, the adsorption capacity and photocatalytic behavior of solvothermally synthesized BiOBr photocatalysts can be optimized via the synergistic effect of Y3+- and I−-doping. After an adsorption reaction in the dark and exposure for another 80 min to visible light, pure BiOBr can remove 46.5% of Congo red (CR) from water with an initial CR concentration of 50 mg L−1. Meanwhile, Bi0.8Y0.20OBr0.97I0.03, the co-doped catalyst, displays total degradation rates exceeding 98% and 92% with CR dosages of 50 and 100 mg L−1, respectively, demonstrating a doubled degradation capacity. With the co-doping solution, the negative charges on the catalysts reduce, more oxygen vacancies are generated, the bandgap remarkably narrows, and the photoabsorption range broadens for derivation of photoinduced electron–hole pairs. The mechanism for optimized photodegradation behavior and dramatically increased adsorption capacity are discussed based on analyses of the structural evolution, surface properties including the chemical state and surface charge, electrochemical performance and the yield/type of photogenerated species. Density functional theory (DFT) simulations were conducted to investigate the structural state, density of states (DOS) and electrostatic potential. [ABSTRACT FROM AUTHOR]

Aiming at the phenomenon that a high-power torque converter is susceptible to cavitation, which leads to performance degradation, first, a transient flow field model of the torque converter is established, and CFD simulation and experimental research on the torque converter are carried out to find out the speed ratio region where cavitation occurs in the torque converter as well as the rule of occurrence of cavitation, and then the cavitation identification method based on the difference between the inlet and outlet flow of the torque converter is proposed. Then, the transient flow process inside the torque converter is analyzed, and it is pointed out that the angle between the inlet angle of the stator and the outlet angle of the turbine of the torque converter, i.e., the fluid inflow injection deviation angle is an important factor affecting the cavitation phenomenon. By adjusting the key parameters of the stator blade bone line, the fluid inflow deviation angle of the torque converter stator is optimized, so that the speed ratio range of cavitation under large load conditions is greatly reduced from the original 0–0.5 (50%) to 0–0.15 (15%). Meanwhile, in terms of test performance, the nominal torque of the torque converter is greatly improved under the premise of ensuring that the performance is basically unchanged, in which the nominal torque of the test zero speed is increased by 28.7%, and the cavitation of the torque converter has been greatly improved. [ABSTRACT FROM AUTHOR]

At the present stage, the identification of dangerous behaviors in public places mostly relies on manual work, which is subjective and has low identification efficiency. This paper proposes an automatic identification method for dangerous behaviors in public places, which analyzes group behavior and speech emotion through deep learning network and then performs multimodal information fusion. Based on the fusion results, people can judge the emotional atmosphere of the crowd, make early warning, and alarm for possible dangerous behaviors. Experiments show that the algorithm adopted in this paper can accurately identify dangerous behaviors and has great application value. [ABSTRACT FROM AUTHOR]

Neuromuscular blocking agents (NMBAs) are routinely used during anesthesia to relax skeletal muscle. Nicotinic acetylcholine receptors (nAChRs) are ligand-gated ion channels; NMBAs can induce muscle paralysis by preventing the neurotransmitter acetylcholine (ACh) from binding to nAChRs situated on the postsynaptic membranes. Despite widespread efforts, it is still a great challenge to find new NMBAs since the introduction of cisatracurium in 1995. In this work, an effective ensemble-based virtual screening method, including molecular property filters, 3D pharmacophore model, and molecular docking, was applied to discover potential NMBAs from the ZINC15 database. The results showed that screened hit compounds had better docking scores than the reference compound d-tubocurarine. In order to further investigate the binding modes between the hit compounds and nAChRs at simulated physiological conditions, the molecular dynamics simulation was performed. Deep analysis of the simulation results revealed that ZINC257459695 can stably bind to nAChRs' active sites and interact with the key residue Asp165. The binding free energies were also calculated for the obtained hits using the MM/GBSA method. In silico ADMET calculations were performed to assess the pharmacokinetic properties of hit compounds in the human body. Overall, the identified ZINC257459695 may be a promising lead compound for developing new NMBAs as an adjunct to general anesthesia, necessitating further investigations. [ABSTRACT FROM AUTHOR]

Sex chromosomes evolved from autosomes many times across the eukaryote phylogeny. Several models have been proposed to explain this transition, some involving male and female sterility mutations linked in a region of suppressed recombination between X and Y (or Z/W, U/V) chromosomes. Comparative and experimental analysis of a reference genome assembly for a double haploid YY male garden asparagus (Asparagus officinalis L.) individual implicates separate but linked genes as responsible for sex determination. Dioecy has evolved recently within Asparagus and sex chromosomes are cytogenetically identical with the Y, harboring a megabase segment that is missing from the X. We show that deletion of this entire region results in a male-to-female conversion, whereas loss of a single suppressor of female development drives male-to-hermaphrodite conversion. A single copy anther-specific gene with a male sterile Arabidopsis knockout phenotype is also in the Y-specific region, supporting a two-gene model for sex chromosome evolution.