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FOOD CHEMISTRY · 2025 · IF 9.8

Characterization of an epilactose-producing cellobiose 2-epimerase from Clostridium sp. TW13 and reutilization of waste milk

Zhou Chen,Yanyin Song,Yuhan Yan,Wei Chen,Tong Ren,Aijin Ma,Siting Li,Yingmin Jia

A novel cellobiose 2-epimerase gene ( CsCEase1 ) from Clostridium sp. TW13 was successfully overexpressed. Cs CEase1, with a molecular mass of 45.0 kDa, exhibited a specific activity of 254.75 U/mg and showed optimal activity at 40 °C and pH 7.5. Using Cs CEase1, 44.30 % of lactose was converted into epilactose, yielding a production level of 26.58 g/L. An efficient purification method was developed, incorporating crystallization and β-galactosidase treatment to remove the unconverted lactose, while Saccharomyces cerevisiae was used to consume the produced glucose. Final purification with activated carbon resulted in epilactose with 98 % purity and a recovery rate of 66.47 %. Furthermore, Cs CEase1 was incubated with whey power and expired milk, achieving epilactose conversion rates of 29.65 % and 32.69 %, respectively. These findings highlight the potential of Cs CEase1 for the cost-effective and environmentally sustainable production of epilactose from dairy waste.

CAS / MDL: 7440-44-0
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International Journal of Clinical and Experimental Pathology · 2017 · IF 1.706

Control-released Alpha-lipoic acid-loaded PLGA microspheres enhance bone formation in type 2 diabetic rat model

Zhan-Zhao Zhang,Lu Song,Zhi-Yong Zhang,Ming-Ming Lv

Since diabetes lead to alterations in bone metabolism with reductions in bone mineral content and delayed bone formation, the most effective method for bone regeneration in diabetes remains to be determined. In this study, type 2 diabetes were successfully induced via a high-fat diet and low-dose streptozotocin intraperitoneal injection. Excess reactive oxygen species (ROS) has been implicated in diabetes mellitus. Overexpression of ROS can lead to oxidative stress and subsequently to H 2 O 2 -mediated impaired proliferation and delayed cellular differentiation. As a result, antioxidant alpha-lipoic acid (ALA)-loaded poly (lactic-co-glycolic acid) (PLGA) microspheres were fabricated using the emulsion solvent evaporation method, and a sustained and controlled release of ALA was observed up to 27 days. It was demonstrated that biodegradable PLGA microspheres loaded with ALA acted as ROS scavengers and partially recover the mesenchymal stem cell proliferation and differentiation. The bone formation of ALA loaded scaffolds in rat cranial bone defects were greater than the prime three-dimensional collagen scaffold. These results suggest the application of ALA loaded PLGA microsphere exhibit good bioactivity and bone forming ability in diabetes.

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Environmental Science-Water Research & Technology · 2024 · IF 3.5

Microwave irradiation synthesis of CoFe2O4/rGO to activate peroxymonosulfate for the degradation of 2-aminobenzothiazole in water

Wei Wei,Shiqian Gao,Feiyue Qian,Chongjun Chen,Youyi Wu

Reduced graphene oxide modified CoFe2O4 (CoFe2O4/rGO) magnetic nanoparticles (MNPs) were synthesized by employing an in situ crystallization microwave irradiation method. The morphology and textural properties of CoFe2O4/rGO were characterized using SEM, TEM, BET/BJH and XPS. GO was reduced to rGO via the thermal catalysis of Co(acac)2, which contributed to expanding the effective microwave absorption bandwidth of carbon-based materials. The lattice stability of CoFe2O4 effectively improved Snoek's limit and protected the catalytic active site distribution of CoFe2O4/rGO nanoparticles. The CoFe2O4/rGO composites were selected as a heterogeneous catalyst to initiate the activation of peroxymonosulfate (PMS) for the generation of reactive oxygen species (ROS) and degrade 2-aminobenzothiazole (ABT) in a water sample. Under optimal conditions, the coupling of CoFe2O4/rGO and PMS can completely degrade ABT in aqueous solutions within 90 minutes. The effect of inorganic anions, metal cations and humic acid (HA) on the degradation efficiency of ABT was explored. Experimental results showed that the presence of HA and low concentrations of Cu2+ enhanced the process performance remarkably, while the addition of NO3−, SO42−, Zn2+, Cd2+ and high concentrations of Cu2+ suppressed the degradation of ABT. Meanwhile, the absence of Cl− and HCO3− presented no significant influence on the degradation. Radical quenching experiments indicated that SO4−·, ·OH and non-free radicals of 1O2 were involved in the CoFe2O4/rGO-PMS system, with the former two being the dominating radical species. A degradation efficiency of 100% was obtained when the proposed method was applied to the degradation of ABT in actual water samples. The CoFe2O4/rGO catalyst-activated PMS processes offered a reference to eliminate refractory organics in water.

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INTERNATIONAL JOURNAL OF HYDROGEN ENERGY · 2024 · IF 8.1

MoO3/V2O5/Ni(OH)2 with multiple heterojunction interfaces for the hydrogen preparation from urea-containing wastewater

Yaohao Zhang,Kaifen Luo,Lijuan Peng,Jiahuan Zhong,Chengkai Zhang,Dingsheng Yuan

Compared to a single heterostructure , constructing multiple heterojunction interfaces to enhance bifunctional catalytic activity still faces challenges. Herein, a nanoflower-like electrocatalyst with multiple heterojunction interfaces, which consists of MoO 3 , V 2 O 5 , and Ni(OH) 2 in-situ grown on nickel foam, is prepared through a one-step hydrothermal method (MoO 3 /V 2 O 5 /Ni(OH) 2 /NF, named MVN/NF). The MVN/NF exhibits superior catalytic performance, attributable to enhanced electron transfer facilitated by numerous heterojunction interfaces, a substantial active specific surface area , and a self-supported architecture. It requires low potentials for hydrogen evolution reaction , urea oxidation reaction , and overall urea electrolysis of 81 mV, 1.351 V, and 1.450 V (vs. RHE), respectively, to reach a current density of 10 mA cm −2 . By cutting the material into a large-scale electrode for use in an alkaline electrolyzer , its Faraday efficiency was 90.0%, and the urea decomposition rate reached 45.1%. This work offers broad application prospects for the realization of large-scale hydrogen production and the decomposition of urea-containing wastewater.

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Polymers · 2025 ·Vol. 17 ·期 5 ·679 · IF 4.9

Preparation of 3-Iodo-2-propargyl-butyl-carbamate-Loaded Microcapsules for Long-Term Mold Resistance in Bamboo

Gege Bao,Lu He,Xiaofeng Zhang,Xi Yu,Jingpeng Li,Daochun Qin

Bamboo, recognized as a nutrient-dense biomass material, exhibits a high susceptibility to mold infestations, which can result in discoloration and a notable decrease in longevity, thereby posing potential health risks to humans. In this study, melamine-formaldehyde resin (MFR) was utilized to load 3-iodo-2-propargyl-butyl-carbamate (IPBC) via in situ polymerization, resulting in the preparation of microcapsules suitable for anti-mold protection of bamboo. The mold resistance ofAspergillus niger,Trichoderma viride, andPenicillium citrinumwere evaluated. A scanning electron microscope (SEM), transmission electron microscope (TEM), Fourier-transform infrared spectrometer (FTIR), and thermogravimetric analysis (TG) were used to characterize and analyze the formation process, surface morphology, structural composition, and thermal stability of the microcapsules. The effects of different surfactants (Span 80, Tween 80, SDBS, SDS, GA) on the microscopic morphology of the anti-mold microcapsules were investigated. The results show that microcapsules prepared with Tween 80 as the surfactant exhibited good mold resistance. After coating MFR with IPBC, the drug loading of I-MFR is 20%, with an encapsulation efficiency of 80%, demonstrating excellent anti-mold performance. The microcapsules show favorable anti-mold performance and have broad application prospects in bamboo protection.

CAS / MDL: 55406-53-6
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LANGMUIR · 2024 · IF 3.7

Multifunctional Conductive MOFs Enhance the Photocatalytic Hydrogen Evolution Efficiency of S-Type Ni3(HITP)2/TiO2 Heterojunctions

Xiaotian Zhang,Zipeng Jin,Kunting Li,Yisheng Hu,Lei Xu,Baiyan Li

Despite their high surface area, remarkable porosity, and efficient charge transfer mechanisms, conductive MOFs have found limited utilization within the domain of photocatalysis. In this study, we synthesized a cutting-edge S-type Ni3(HITP)2/TiO2 heterojunction photocatalyst exhibiting outstanding light harvesting and prolonged lifetime of photogenerated electrons through an in situ synthesis approach. Compared with TiO2, the composite materials not only significantly increase the specific surface area by 4.07 times but also expand the visible light absorption edge from 400 to 1100 nm. The hydrogen production rate of Ti/Ni-3 reached 4.927 mmol·g–1·h–1, which is 4.51 times that of TiO2. The S-type interface charge transfer pathway of the Ni3(HITP)2/TiO2 composite material was inferred by band structure, in situ XPS, SPV, and free radical capture, which improves charge separation and extends the carrier lifetime to undergo directional migration driven by an IEF. This is the main reason for the improved photocatalytic performance of Ni3(HITP)2/TiO2 composite materials.

CAS / MDL: 64-17-5 64-19-7
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ECOTOXICOLOGY AND ENVIRONMENTAL SAFETY · 2024 · IF 6.2

Physiologically based toxicokinetic modelling of Tri(2-chloroethyl) phosphate (TCEP) in mice accounting for multiple exposure routes

Jiaqi Ding,Wanyu He,Wanxiao Sha,Guoqiang Shan,Lingyan Zhu,Lin Zhu,Jianfeng Feng

Exposure routes are important for health risk assessment of chemical risks. The application of physiologically based toxicokinetic (PBTK) models to predict concentrations in vivo can determine the effects of harmful substances and tissue accumulation on the premise of saving experimental costs. In this study, Tri(2-chloroethyl) phosphate (TCEP), an organophosphate ester (OPE), was used as an example to study the PBTK model of mice exposed to different exposure doses by multiple routes. Different routes of exposure (gavage and intradermal injection) can cause differences in the concentration of chemicals in the organs. TCEP that enters the body through the mouth is mainly concentrated in the gastrointestinal tract and liver. However, the concentrations of chemicals that enter the skin into the mice are higher in skin, rest of body, and blood. In addition, TCEP was absorbed and accumulated very rapidly in mice, within half an hour after a single exposure. We have successfully established a mouse PBTK model of the TCEP accounting for multiple exposure Routes and obtained a series of kinetic parameters. The model includes blood, liver, kidney, stomach, intestine, skin, and rest of body compartments. Oral and dermal exposure route was considered for PBTK model. The PBTK model established in this study has a good predictive ability. More than 70% of the predicted values deviated from the measured values by less than 5-fold. In addition, we extrapolated the model to humans. A human PBTK model is built. We performed a health risk assessment for world populations based on human PBTK model. The risk of TCEP in dust is greater through mouth than through skin. The risk of TCEP in food of Chinese population is greater than dust.

CAS / MDL: 64-18-6
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CHEMOSPHERE · 2024 · IF 8.1

Toxicological effects of di(2-ethylhexyl)phthalate on dandelions: Insights into physiological, metabolic, and molecular docking perspectives

Xinyi Du,Xingfan Li,Minghui Yang,Zhiqiang He,Tianwei Xu,Jia Liu,Xiaorui Guo,Zhonghua Tang

Di(2-ethylhexyl)phthalate (DEHP) is one of the most widely used plasticizers in plastic manufacturing. However, the toxicological effects of DEHP on dandelions remain poorly understood. This study comprehensively analyzed and explored the response mechanisms of dandelions to 1, 10, 50, and 100 mg L −1 DEHP influencing the morphophysiological growth, metabolomics, and molecular docking. DEHP reduced chlorophyll synthesis, inhibited plant growth, and induced oxidative-state-associated stress, which was manifested by the excessive production of reactive oxygen species, an increase in antioxidant enzyme activities, and enhanced synthesis of some osmoregulatory compounds, including proline and soluble protein. An analysis of the integrated biological response index showed that the toxicity was dose-dependent. Molecular docking demonstrated that DEHP could bind stably to three enzymes, and the binding energy was peroxidase (POD) > catalase (CAT) > superoxide dismutase (SOD). Metabolomics revealed that metabolite abundance and metabolic pathways were altered by DEHP, with 88 and 72 primary metabolites identified in shoots and roots, respectively. Amino acid, sugar, and organic acid metabolism were severely disturbed, with the most significant effects being on carbohydrate metabolism, valine, leucine, and isoleucine biosynthesis. Our study elucidated the influence of DEHP exposure on dandelions, providing new insights into the toxicity mechanisms and toxicological risk assessment.

CAS / MDL: 67-56-1
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JOURNAL OF SOLID STATE CHEMISTRY · 2024 · IF 3.2

Trifluoromethyl-functionalized zirconium-based metal-organic cage (ZrT-(CF3)2): An efficient adsorbent for salicylic acid removal

Jian Li,Shuai-Bing Ma,De-Sheng Wei,Wan-Yi Lan,Ting-Ting Xu,Yu-Teng Zhang,Nan Lv,Shuang-Bao Li

Herein, a novel CF 3 -functionalized zirconium-based metal-organic tetrahedron (ZrT-(CF 3 ) 2 ) was constructed based on 2.5-bis(trifluoromethyl)terephthalic acid (H 2 BDC-(CF 3 ) 2 ) ligand and trinuclear zirconocene building unit. Notably, the single crystals of ZrT-(CF 3 ) 2 was obtained under traditional solvothermal condition, while the yield and purity could be further improved by the microwave-assisted solvothermal method. Subsequently, the adsorption performance of ZrT-(CF 3 ) 2 for salicylic acid (SA) emerging contaminant was systematically evaluated, indicating a maximum adsorption capacity of 99.91 mg/g under optimal conditions. Furthermore, a possible adsorption mechanism was proposed based on experimental results and DFT simulations.

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JOURNAL OF LUMINESCENCE · 2024 · IF 3.3

Unravelling the effect of interstitial oxygen on the photoluminescence of Ce3+-doped Ca2BO3Cl and Ca3(BO3)2

Aynigar Ablat,Min Yin,Shihang Zhou,Aierken Sidike

Ce 3+ -doped Ca 2 BO 3 Cl and Ca 3 (BO 3 ) 2 are presented as promising phosphors for solid-state white light illumination, display, phototherapy, etc. Herein, we combined experimental and first-principles calculations to study the photoluminescence properties of Ce 3+ -doped Ca 2 BO 3 Cl and Ca 3 (BO 3 ) 2 under different preparation environment. The results show that the co-doped Na  +  ions have little effect on the luminescence of Ce 3+ ions doped Ca 2 BO 3 Cl and Ca 3 (BO 3 ) 2 . However, the luminous intensity of Ce 3+ /Na + ions co-doped Ca 2 BO 3 Cl greatly decreased with increasing oxidizing atmosphere. When sintering at 800 °C in air, the luminescence intensity was more than 10 times lower than that in a reducing atmosphere (5 % H 2  + 95 % N 2 ), whereas the luminescence intensity of Ce 3+ -doped Ca 3 (BO 3 ) 2 hardly changed. First-principles calculations revealed that, within an enhanced oxidizing atmosphere, the formation energy of interstitial oxygen (O i ) in Ca 2 BO 3 Cl:Ce 3+ ,Na + decreased from 2.84 to 0.31 eV, whereas in Ca 3 (BO 3 ) 2 :Ce 3+ , it decreased from 2.11 to 1.51 eV. The small formation energy (0.31 eV) of interstitial oxygen (O i ) in an oxidation atmosphere may lead to the formation of interstitial oxygen defects in Ca 2 BO 3 Cl:Ce 3+ ,Na + , which may result in the luminescence quenching of Ce 3+ ions in Ca 2 BO 3 Cl:Ce 3+ ,Na + ((Ce 3+ )∗+O 0 →Ce 4+ +O 1− ) and cause a decrease in the luminescence intensity. The study of the difference in resistance to oxidation between Ce 3+ -doped Ca 2 BO 3 Cl and Ca 3 (BO 3 ) 2 is highly important for further improving current luminescent materials and developing new functional materials.

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JOURNAL OF MEMBRANE SCIENCE · 2025 · IF 9

Transforming PA RO membrane with [3-(2-aminoethyl) aminopropyl] triethoxysilane (AEAPTES) for superior antifouling and water purification

Qianqian Zhao,Haiqi Jia,Wenxiong Shi,Shaolu Li,Xiaohui Yi,Siqi Yin,Genghao Gong,Yunxia Hu

Aromatic polyamide (PA) reverse osmosis (RO) membrane has gained widespread usage in desalination and water production. Nevertheless, their surfaces are prone to fouling during practical applications stemming from their inherent physicochemical properties. Therefore, conducting research on enhancing the antifouling properties of PA membranes through surface modification is of significant importance. In this work, high-flux and superior antifouling RO membranes were fabricated via surface grafting and self-crossing of [3-(2-aminoethyl) aminopropyl] triethoxysilane (AEAPTES) on the pristine PA membrane surface. Benefiting from solvent activation by n-hexane/n-decane and the strong hydrophilicity of AEAPTES, the modified membranes showed a significant enhancement in water permeance by approximately 73 % (reaching up to 4.10 LMH/bar) compared to unmodified PA membrane, while maintaining NaCl rejection above 98.67 %. Additionally, the modified membrane exhibited outstanding stability. Dynamic fouling experiments with charged model foulants of varying molecular sizes, supported by molecular dynamics simulation analysis, demonstrated that the surface charge plays a crucial role in resisting small-molecule foulants, while hydrophilicity is more effective against macromolecule foulants. Although AEAPTES incorporation did not improve the antifouling performance to negatively charged sodium dodecyl sulfate (SDS), it significantly improved resistance to positively charged dodecyl trimethyl ammonium bromide (DTAB) and charged protein model foulants, including lysozyme (LYZ) and bovine serum albumin (BSA). These improvements are attributed to the creation of a thick hydration layer, as well as the electrostatic interactions and steric hindrance effects provided by the AEAPTES modified layer. This research offers new perspectives on the antifouling mechanisms of PA membranes modified by organoalkoxysilane molecules.

CAS / MDL: 9048-46-8 5872-08-2
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Pharmaceuticals · 2024 ·Vol. 17 ·期 11 ·1420 · IF 4.3

Virtual Screening, Molecular Dynamics, and Mechanism Study of Homeodomain-Interacting Protein Kinase 2 Inhibitor in Renal Fibroblasts

Xinlan Hu,Yan Wu,Hanyi Ouyang,Jiayan Wu,Mengmeng Yao,Zhuo Chen,Qianbin Li

Background/Objectives:Homeodomain-interacting protein kinase 2 (HIPK2) is critically involved in the progression of renal fibrosis. This study aims to identify and characterize a novel HIPK2 inhibitor, CHR-6494, and investigate its therapeutic potential.Methods:Using structure-based virtual screening and molecular dynamics simulations, we identified CHR-6494 as a potent HIPK2 inhibitor with an IC50of 0.97 μM. The effects of CHR-6494 on the phosphorylation of p53 in Normal Rattus norvegicus kidney cells (NRK-49F) induced by transforming growth factor-β (TGF-β) were assessed, along with its impact on TGF-β signaling and downstream profibrotic markers.Results:CHR-6494 significantly reduces p53 phosphorylation induced by TGF-β and enhances the interaction between HIPK2 and seven in absentia 2 (SIAH2), facilitating HIPK2 degradation via proteasomal pathways. Both CHR-6494 and Abemaciclib inhibit NRK-49F cell proliferation and migration induced by TGF-β, suppressing TGF-β/Smad3 signaling and decreasing profibrotic markers such as Fibronectin I (FN-I) Collagen I and α-smooth muscle actin (α-SMA). Additionally, these compounds inhibit nuclear factor kappa-B (NF-κB) signaling and reduce inflammatory cytokine expression.Conclusions:The study highlights the dual functionality of HIPK2 kinase inhibitors like CHR-6494 and Abemaciclib as promising therapeutic candidates for renal fibrosis and inflammation. The findings provide new insights into HIPK2 inhibition mechanisms and suggest pathways for the design of novel HIPK2 inhibitors in the future.

CAS / MDL: 1231930-82-7
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