Babesia Bovis Ligand-Receptor Interaction: AMA-1 Contains Small Regions Governing Bovine Erythrocyte Binding

Apical membrane antigen 1 is a microneme protein which plays an indispensable role during Apicomplexa parasite invasion. The detailed mechanism of AMA-1 molecular interaction with its receptor on bovine erythrocytes has not been completely defined in Babesia bovis. This study was focused on identifying the minimum B. bovis AMA-1-derived regions governing specific and high-affinity binding to its target cells. Different approaches were used for detecting ama-1 locus genetic variability and natural selection signatures. The binding properties of twelve highly conserved 20-residue-long peptides were evaluated using a sensitive and specific binding assay based on radio-iodination. B. bovis AMA-1 ectodomain structure was modelled and refined using molecular modelling software. NetMHCIIpan software was used for calculating B- and T-cell epitopes. The B. bovis ama-1 gene had regions under functional constraint, having the highest negative selective pressure intensity in the Domain I encoding region. Interestingly, B. bovis AMA-1-DI (¹⁰⁰YMQKFDIPRNHGSGIYVDLG¹¹⁹ and ¹²⁰GYESVGSKSYRMPVGKCPVV¹³⁹) and DII (³⁰²CPMHPVRDAIFGKWSGGSCV³²¹)-derived peptides had high specificity interaction with erythrocytes and bound to a chymotrypsin and neuraminidase-treatment sensitive receptor. DI-derived peptides appear to be exposed on the protein’s surface and contain predicted B- and T-cell epitopes. These findings provide data (for the first-time) concerning B. bovis AMA-1 functional subunits which are important for establishing receptor-ligand interactions which could be used in synthetic vaccine development.     

BMS Derivatives C7-Linked to β-Cyclodextrin and Hyperbranched Polyglycerol Retain Activity against R5-HIV-1NLAD8 Isolates and Can Be Deemed Potential Microbicides

Amides from indole-3-glyoxylic acid and 4-benzoyl-2-methylpiperazine, which are related to entry inhibitors developed by Bristol-Myers Squibb (BMS), have been synthesized with aliphatic chains located at the C7 position of the indole ring. These spacers contain an azido group suitable for the well-known Cu(I)-catalyzed (3+2)-cycloaddition or an activated triple bond for the nucleophilic addition of thiols under physiological conditions. Reaction with polyols (β-cyclodextrin and hyperbranched polyglycerol) decorated with complementary click partners has afforded polyol-BMS-like conjugates that are not cytotoxic (TZM.bl cells) and retain the activity against R5-HIV-1_NLAD8 isolates. Thus, potential vaginal microbicides based on entry inhibitors, which can be called of 4^th generation, are reported here for the first time.     

Molecular fingerprint and machine learning to accelerate design of high-performance homochiral metal–organic frameworks

Computational screening was employed to calculate the enantioseparation capabilities of 45 functionalized homochiral metal–organic frameworks (FHMOFs), and machine learning (ML) and molecular fingerprint (MF) techniques were used to find new FHMOFs with high performance. With increasing temperature, the enantioselectivities for (R,S)-1,3-dimethyl-1,2-propadiene are improved. The “glove effect” in the chiral pockets was proposed to explain the correlations between the steric effect of functional groups and performance of FHMOFs. Moreover, the neighborhood component analysis and RDKit/MACCS MFs show the highest predictive effect on enantioselectivities among the four ML classification algorithms with nine MFs that were tested. Based on the importance of MF, 85 new FHMOFs were designed, and a newly designed FHMOF, NO₂-NHOH-FHMOF, with high similarity to the optimal MFs achieved improved chiral separation performance, with enantioselectivities of 85%. The design principles and new chiral pockets obtained by ML and MFs could facilitate the development of new materials for chiral separation.     

Stable power supply of an independent power source for a remote island using a Hybrid Energy Storage System composed of electric and hydrogen energy storage systems

We propose a self-sustaining power supply system consisting of a “Hybrid Energy Storage System (HESS)” and renewable energy sources to ensure a stable supply of high-quality power in remote islands. The configuration of the self-sustaining power supply system that can utilize renewable energy sources effectively on remote islands where the installation area is limited is investigated. It is found that it is important to select renewable energy sources whose output power curve is close to the load curve to improve the efficiency of the system. The operation methods that can increase the cost-effectiveness of the self-sustaining power supply system are also investigated. It is clarified that it is important for increasing the cost effectiveness of the self-sustaining power supply system to operate the HESS with a smaller capacity of its components by setting upper limits on the output power of the renewable energy sources and cutting the infrequent generated power.     

Protection and confinement effect of carbon on Co/CoxOy nano-catalyst for efficient NaBH4 hydrolysis

The hydrolysis of sodium borohydride (NaBH₄) over catalysts is a promising method to produce hydrogen. Although Co-based catalysts exhibit high activity for NaBH₄ hydrolysis, they are still far from satisfying practical applications, especially their poor durability in alkaline media. Herein, a carbon shell structure was designed and synthesized to improve the stability of the mixture of Co⁰ and Co_xO_y nanofilms (Co/Co_xO_y@C) during NaBH₄ hydrolysis via a facile polymerization-pyrolysis strategy with Co/Co_xO_y nanofilms as the precursor. As a result, the Co/Co_xO_y@C catalyst can achieve a remarkable H₂ generation rate of 4348.6 mL min^?1 g_Co^?1 with a low activation energy of 43.6 kJ mol^?1, which is superior to most previously reported catalysts. Moreover, the catalyst shows high stability with an H₂ generation-specific rate of 79% after five cycles. The excellent performance of carbon substrate can well prevent the agglomeration of Co-based nanoparticle and improve the corrosion resistance of the active Co to BO₂^? and OH^?. This work would widen the road for the preparation of nanoconfined catalysts, which has prospective application potentials for H₂ production from NaBH₄ hydrolysis.     

Entropy analysis of unsteady MHD three-dimensional flow of Williamson nanofluid over a convectively heated stretching sheet

This article addresses an investigation of the entropy analysis of Williamson nanofluid flow in the presence of gyrotactic microorganisms by considering variable viscosity and thermal conductivity over a convectively heated bidirectionally stretchable surface. Heat and mass transfer phenomena have been incorporated by taking into account the thermal radiation, heat source or sink, viscous dissipation, Brownian motion, and thermophoretic effects. The representing equations are nonlinear coupled partial differential equations and these equations are shaped into a set of ordinary differential equations via a suitable similarity transformation. The arising set of ordinary differential equations was then worked out by adopting a well-known scheme, namely the shooting method along with the Runge-Kutta-Felberge integration technique. The effects of flow and heat transfer controlling parameters on the solution variables are depicted and analyzed through the graphical presentation. The survey finds that magnifying viscosity parameter, Weissenberg number representing the non-Newtonian Williamson parameter cause to retard the velocity field in both the directions and thermal conductivity parameter causes to reduce fluid temperature. The study also recognizes that enhancing magnetic parameters and thermal conductivity parameters slow down the heat transfer rate. The entropy production of the system is estimated through the Bejan number. It is noticeable that the Bejan number is eminently dependent on the heat generation parameter, thermal radiation parameter, viscosity parameter, thermal conductivity parameter, and Biot number. The skillful accomplishment of the present heat and mass transfer system is achieved through the exteriorized choice of the pertinent parameters.     

A new signal processing-based islanding detection method using pyramidal algorithm with undecimated wavelet transform for distributed generators of hydrogen energy

Machine learning-based fault detection methods are frequently combined with wavelet transform (WT) to detect an unintentional islanding condition. In contrast to this condition, these methods have long detection and computation time. Thus, selecting a useful signal processing-based approach is required for reliable islanding detection, especially in real-time applications. This paper presents a new modified signal processing-based islanding detection method (IDM) for real-time applications of hydrogen energy-based distributed generators. In the study, a new IDM using a modified pyramidal algorithm approach with an undecimated wavelet transform (UWT) is presented. The proposed method is performed with different grid conditions with the presence of electric noise in real-time. Experimental results show that oscillations in the acquired signal can be reduced by the UWT, and noise sensitivity is lower than other WT-based methods. The non-detection zone is zero and the maximum detection and computational time is also 75 ms at a close power match.     

Ni–Cr alloys for effectively enhancing hydrogen evolution processes in phosphate-buffered neutral electrolytes

Significant efforts have been made to develop highly active non-noble metal-based, affordable metallic and stable electro-catalysts for hydrogen evolution reaction (HER). Strong acid and bases are now used in HER operations to achieve large-scale, sustained H₂ fuel production. However, few studies have utilized phosphate-buffered neutral electrolytes (PBS) in the field of neutral electrolyte technology. In this work, a certain alloys with a Ni–Cr basis have been produced as favorable components for the HER under neutral conditions. Additionally, the current investigations are emphasizing on the concentration of buffer phosphate species in the HER activity of various materials. By employing polarization and electrochemical impedance spectroscopy (EIS) in neutral solutions, the electro-catalytic activity of new alloys on HER was evaluated. According to the preliminary findings, the examined Ni–Cr-based alloys show superior HER catalytic activity in neutral electrolytes. Additionally, the Ni–Cr alloy matrix with Fe and Mo added enhances HER electrocatalytic efficiency while lowering interfacial charge transfer resistance. Due to its low overpotential of ?297 mV @ 10 mA cm^?2 and Tafel slope of 94 mV dec^?1 in 1.0 M PBS media, the Ni–Cr–Mo–Fe alloy exhibits an efficient HER, suggesting that the Ni–Cr–Mo–Fe electrode will be a potential noble metal-free electro-catalyst for HER. The Ni–Cr–Mo–Fe cathode is a readily available and affordable material for the production of HER in neutral medium.     

基于VMD和改进TCN的短期光伏发电功率预测

光伏发电功率存在波动性,且光伏出力易受各种气象特征影响,传统TCN网络容易过度强化空间特性而弱化个体特性。针对上述问题,文中提出一种基于VMD和改进TCN的短期光伏发电功率预测模型。通过VMD将原始光伏发电功率时间序列分解为若干不同频率的模态分量,将各个模态分量以及相对应的气象数据输入至改进TCN网络进行建模学习。利用中心频率法确定VMD的最优分解模态分解个数。在传统TCN预测模型的基础上,使用DropBlock正则化取代Dropout正则化以达到抑制卷积层中信息协同的效果,并引入注意力机制自主挖掘并突出关键气象输入特征的影响,量化各气象因素对光伏发电的影响,从而提高预测精度。以江苏省某光伏电站真实数据为例进行仿真实验,结果表明所提预测方法的RMSE为0.62 MW,MAPE为2.03%。     

Systematic analysis and multi-objective optimization of an integrated power and freshwater production cycle

This study represents the results of the analysis and optimization of an integrated system for cogenerating electricity and freshwater. This setup consists of a Solid Oxide Fuel cell (SOFC) for producing electricity. Unburned fuel of the SOFC is burned in the afterburner to increase the temperature of the SOFC's outlet gasses and operate a Gas turbine (GT) to produce additional power and operate the air compressor. At the bottom of this cycle, a combined setup of a Multi-Effect Desalination (MED) and Reverse Osmosis (RO) is considered to produce freshwater from the unused heat capacity of the GT's exhaust gasses. Also, a Stirling engine is used in the fuel supply line to increase the fuel's temperature. Using LNG and the Stirling engine will replace the fuel compressor with a pump which increases the system performance and eliminates the need for the expansion valve. To study the system performance a mathematical model is developed in Engineering Equation Solver (EES) program. Then, the system's simulated data from the EES has been sent to MATLAB to promote the best operating condition based on the optimization criteria. An energetic, exergetic, economic, and environmental analysis has been performed and a Non-dominated Sorting Genetic Algorithm (NSGA-II) is used to achieve the goal. The two-objective optimization is performed to maximize the exergetic efficiency of the proposed system while minimizing the system's total cost of production. This cost is a weighted distribution of the Levelized Cost of Electricity (LCOE) and Levelized Cost of freshwater (LCOW). The results showed that the exergetic and energetic efficiencies of the system can reach 73.5% and 69.06% at the optimum point. The total electricity production of the system is 99 MW. The production cost is 11.71 Cents/kWh, of which 1.04 Cents/kWh is emission-related and environmental taxes. The freshwater production rate is 42.44 kg/s which costs 4.38 USD/m³.