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1.
J Genet Psychol ; : 1-14, 2024 Oct 10.
Artigo em Inglês | MEDLINE | ID: mdl-39390776

RESUMO

Academic shame has been found to interfere with motivation and, in turn, affect students' academic goals and achievements. This study explored the factors that influence academic shame and the underlying mechanisms among high school students by investigating the influence of family socioeconomic status on academic shame and the mediating roles of self-control and gratitude. A total of 957 high school students participated in this study and completed the Family Socioeconomic Status Questionnaire, Self-Control Scale, Adolescents' Gratitude Scale, and Academic Shame Scale. Descriptive statistics consisted of means and standard deviations. Pearson's correlations were used to test the strength of relationships among the research variables. A structural equation model was constructed, and the significance of the mediating effects was tested by percentile bootstrap analysis with deviation correction. The results showed that family socioeconomic status was positively correlated with self-control and negatively correlated with academic shame; self-control was positively correlated with gratitude and negatively correlated with academic shame; and gratitude was positively correlated with academic shame. Self-control played a mediating role between family socioeconomic status and academic shame, and self-control and gratitude played a chain mediating role between family socioeconomic status and academic shame. The mediating effect was a masking effect. Therefore, family socioeconomic status directly and negatively affected academic shame among senior high school students, and indirectly affected their academic shame through self-control and gratitude.

2.
Nat Commun ; 15(1): 8504, 2024 Oct 01.
Artigo em Inglês | MEDLINE | ID: mdl-39353924

RESUMO

The seventh cholera pandemic started in 1961 in Indonesia and spread across the world in three waves in the decades that followed. Here, we utilised genomic evidence to detail the first wave of the seventh pandemic. Genomes of 22 seventh pandemic Vibrio cholerae isolates from 1961 to 1979 were completely sequenced. Together with 152 publicly available genomes from the same period, they fell into seven phylogenetic clusters (CL1-CL7). By multilevel genome typing (MGT), all were assigned to MGT2 ST1 (Wave 1) except three isolates in CL7 which were typed as MGT2 ST2 (Wave 2). The Wave 1 seventh pandemic expanded in two stages, with Stage 1 (CL1-CL5) spread across Asia and Stage 2 (CL6 and CL7) spread to the Middle East and Africa. Three non-synonymous mutations, one each, in three regulatory genes, csrD (global regulator), acfB (chemotaxis), and luxO (quorum sensing) may have critically contributed to its pandemicity. The three MGT2 ST2 isolates in CL7 were the progenitors of Wave 2 and evolved from within Wave 1 with acquisition of a novel IncA/C plasmid. Our findings provide new insight into the evolution and transmission of the early seventh pandemic, which may aid future cholera prevention and control.


Assuntos
Cólera , Genoma Bacteriano , Pandemias , Filogenia , Vibrio cholerae , Cólera/epidemiologia , Cólera/transmissão , Cólera/microbiologia , Humanos , Vibrio cholerae/genética , Vibrio cholerae/isolamento & purificação , Vibrio cholerae/classificação , Genômica/métodos , África/epidemiologia , Indonésia/epidemiologia , Oriente Médio/epidemiologia , Sequenciamento Completo do Genoma
3.
J Physiol ; 2024 Oct 07.
Artigo em Inglês | MEDLINE | ID: mdl-39373834

RESUMO

Computational methods such as molecular dynamics (MD) have illuminated how single-atom ions permeate membrane channels and how selectivity among them is achieved. Much less is understood about molecular permeation through eukaryotic channels that mediate the flux of small molecules (e.g. connexins, pannexins, LRRC8s, CALHMs). Here we describe computational methods that have been profitably employed to explore the movements of molecules through wide pores, revealing mechanistic insights, guiding experiments, and suggesting testable hypotheses. This review illustrates MD techniques such as voltage-driven flux, potential of mean force, and mean first-passage-time calculations, as applied to molecular permeation through wide pores. These techniques have enabled detailed and quantitative modeling of molecular interactions and movement of permeants at the atomic level. We highlight novel contributors to the transit of molecules through these wide pathways. In particular, the flexibility and anisotropic nature of permeant molecules, coupled with the dynamics of pore-lining residues, lead to bespoke permeation dynamics. As more eukaryotic large-pore channel structures and functional data become available, these insights and approaches will be important for understanding the physical principles underlying molecular permeation and as guides for experimental design.

4.
Nat Commun ; 15(1): 9240, 2024 Oct 25.
Artigo em Inglês | MEDLINE | ID: mdl-39455565

RESUMO

Through the energy transfer process, mild transformations can be achieved that are often difficult to realize under thermodynamic conditions. Herein, a visible-light-driven deoxygenative coupling of 1,2-dicarbonyl compounds for C-O, C-S, and C-N bonds construction is developed via triplet state 1,2-dicarbonyls, affording a wide range of α-functionalized ketones/esters under transition-metal and external photocatalyst free conditions. The usefulness of this method is demonstrated by gram-scale synthesis, late-stage functionalization of various carboxylic acid drugs, and the synthesis of natural products and drug molecules.

5.
Redox Biol ; 77: 103392, 2024 Oct 10.
Artigo em Inglês | MEDLINE | ID: mdl-39405980

RESUMO

Ferroptosis induction has emerged as a promising therapeutic approach for prostate cancer (PCa), either as a monotherapy or in combination with hormone therapy. Therefore, identifying the mechanisms regulating ferroptosis in PCa cells is essential. Our previous study demonstrated that HJURP, an oncogene upregulated in PCa cells, plays a role in tumor proliferation. Here, we expand these findings by elucidating a novel mechanism by which HJURP inhibits sensitivity to ferroptosis inducers in PCa cells via the PRDX1/reactive oxygen species (ROS) pathway in vitro and in vivo. Mechanistically, HJURP forms disulfide-linked intermediates with PRDX1 through Cys327 and Cys457 residues. This disulfide binding promotes PRDX1 redox cycling and inhibits its hyperoxidation. As a result, HJURP enhances the peroxidase activity of PRDX1, leading to a decrease in ROS levels and subsequently suppressing lipid peroxidation induced by ferroptosis inducers. These findings reveal the potential of HJURP/PRDX1 as novel therapeutic targets and biomarkers of ferroptosis in PCa patients.

6.
Biomed Pharmacother ; 180: 117588, 2024 Oct 19.
Artigo em Inglês | MEDLINE | ID: mdl-39427550

RESUMO

INTRODUCTION: L-NRB is a compound formed as a ring cleavage product of butylphthalide and borneol in a molar ratio 1:2. This study aimed to explore the therapeutic effect of L-NRB on amyotrophic lateral sclerosis (ALS) and its possible mechanism. METHODS: SOD1-G93A mice were used as an ALS model. Behavioral tests, histopathological staining, Nissl staining, immunohistochemistry, enzyme-linked immunosorbent assays, and Western blotting were used to analyze the therapeutic effect. The underlying mechanism of L-NRB in treating ALS was investigated using transcriptomic analyses. RESULTS: It was found that L-NRB alleviated motor dysfunction, pathological changes in the gastrocnemius muscle, and motor neuron injuries. The results indicated that L-NRB had a neuroprotective function associated with the inhibition of neuroinflammation. The anti-apoptotic effect of L-NRB was found to be related to the regulation of the P11-Htr4 signaling pathway. CONCLUSION: In summary, the results demonstrated the therapeutic effect of L-NRB on ALS and suggest a promising new therapeutic candidate for ALS.

8.
J Agric Food Chem ; 72(37): 20374-20382, 2024 Sep 18.
Artigo em Inglês | MEDLINE | ID: mdl-39231273

RESUMO

Scavenging MGO has been considered as an effective strategy for preventing atherosclerosis. A previous study showed that the total flavonoids of Apocyni Veneti Folium (TFAVF) had a significant antiatherosclerotic effect. However, there are no studies that have investigated the MGO scavenging capacities of TFAVF in mice. We found that TFAVF consisted mainly of quercetin glycosides and kaempferol glycosides using ultrahigh performance liquid chromatography coupled to quadrupole time-of-flight tandem mass spectrometry (UHPLC-QTOF-MS/MS). TFAVF was first demonstrated to effectively scavenge MGO in mice based on the formation of mono-MGO-quercetin, mono-MGO-dehydroquercetin, mono-MGO-isorhamnetin, mono-MGO-dehydroisorhamnetin, mono-MGO-kaempferol, and mono-MGO-dehydrokaempferol. In addition, one mono-MGO-quercetin was separated and purified, and its structure was elucidated as 8-MGO-quercetin based on UHPLC-QTOF-MS/MS and NMR data. Quantification studies have demonstrated that kaempferol, dehydrokaempferol, quercetin, dehydroquercetin, isorhamnetin, and dehydroisorhamnetin can dose dependently scavenge MGO in mice. Taken together, these results indicated that TFAVF showed a significant antiatherosclerotic effect, which might be based on MGO detoxification.


Assuntos
Apocynum , Flavonoides , Aldeído Pirúvico , Espectrometria de Massas em Tandem , Animais , Camundongos , Flavonoides/química , Masculino , Aldeído Pirúvico/química , Cromatografia Líquida de Alta Pressão , Apocynum/química , Extratos Vegetais/química , Humanos , Folhas de Planta/química , Estrutura Molecular , Quercetina/análogos & derivados , Quercetina/química
9.
J Sci Food Agric ; 2024 Sep 04.
Artigo em Inglês | MEDLINE | ID: mdl-39230201

RESUMO

BACKGROUND: Food safety is pivotal for public welfare and directly impacts consumer health. Food safety sampling inspections (FSSIs) are essential in detecting unqualified food products and non-compliant manufacturers, which form an integral part of government regulatory frameworks. However, given the constraints on budgetary resources, improving the efficiency of food safety sampling inspections (EFSSIs) remains a considerable challenge in China's food quality and safety supervision. This study aims to apply Pareto's law, starting from the examination of food sample testing items and major hazard types, to theoretically analyze methods for improving the EFSSIs. Following the theoretical analysis, the research employs provincial food sampling data from China in 2022 to empirically validate the proposed improvement strategies. RESULTS: The research findings indicate that applying Pareto's law significantly reduces the number of items that should be tested for each food subcategory, effectively lowering testing costs for each batch of food samples. Theoretically, employing Pareto's law in sampling inspections can increase the EFSSIs to 2.78 times the current observed level. Furthermore, empirical validation using food sampling data confirms that EFSSIs can be improved to 2.12 times the existing level, consistent with theoretical predictions. CONCLUSION: Implementing Pareto's law in FSSIs facilitates the detection of more unqualified food products and non-compliant manufacturers without additional financial burden, significantly enhancing the EFSSIs. This approach provides an innovative strategy for government to bolster their food safety management efforts. © 2024 Society of Chemical Industry.

10.
BMC Musculoskelet Disord ; 25(1): 703, 2024 Sep 03.
Artigo em Inglês | MEDLINE | ID: mdl-39227806

RESUMO

BACKGROUND: Keen Osteoarthritis (KOA) is a common chronic disabling disease characterized by joint pain and dysfunction, which seriously affects patients' quality of life. Recent studies have shown that transcranial direct current stimulation (tDCS) was a promising treatment for KOA. PURPOSE: Investigate the effects of tDCS on pain and physical function in patients with KOA. METHODS: Randomized controlled trials related to tDCS and KOA were systematically searched in the PubMed, Embase, Medline, Cochrane Library, CINHL, and Web of Science databases from inception to July 23, 2024. The pain intensity was evaluated using the visual analog scale or the numeric rating scale, and the pain sensitivity was assessed using conditioned pain modulation, pressure pain threshold, heat pain threshold, or heat pain tolerance. The physical function outcome was evaluated using the Western Ontario and McMaster Universities Osteoarthritis Index or the Knee injury and Osteoarthritis Outcome Score. Statistical analysis was performed using Review Manager 5.4. RESULTS: Seven studies with a total of 503 participants were included. Compared to sham tDCS, tDCS was effective in reducing the short-term pain intensity (SMD: -0.58; 95% CI: -1.02, -0.14; p = 0.01) and pain sensitivity (SMD: -0.43; 95% CI: -0.70, -0.16; p = 0.002) but failed to significantly improve the long-term pain intensity (SMD: -0.26; 95% CI: -0.59, 0.08; p = 0.13) in KOA patients. In addition, tDCS did not significantly improve the short-term (SMD: -0.13; 95% CI: -0.35, 0.08; p = 0.22) and long-term (SMD: 0.02; 95% CI: -0.22, 0.25; p = 0.90) physical function in patients with KOA. CONCLUSIONS: The tDCS can reduce short-term pain intensity and sensitivity but fails to significantly relieve long-term pain intensity and improve the physical function in patients with KOA. Thus, tDCS may be a potential therapeutic tool to reduce short-term pain intensity and pain sensitivity in patients with KOA.


Assuntos
Osteoartrite do Joelho , Medição da Dor , Ensaios Clínicos Controlados Aleatórios como Assunto , Estimulação Transcraniana por Corrente Contínua , Humanos , Estimulação Transcraniana por Corrente Contínua/métodos , Osteoartrite do Joelho/terapia , Osteoartrite do Joelho/fisiopatologia , Resultado do Tratamento , Medição da Dor/métodos , Artralgia/terapia , Artralgia/diagnóstico , Artralgia/fisiopatologia , Artralgia/etiologia , Limiar da Dor , Manejo da Dor/métodos , Qualidade de Vida , Articulação do Joelho/fisiopatologia
11.
Brain Res ; 1846: 149231, 2024 Sep 11.
Artigo em Inglês | MEDLINE | ID: mdl-39270997

RESUMO

OBJECTIVE: To investigate the correlation and predictive value of white matter hyperintensity (WMH) burden in conjunction with collateral circulation during mechanical thrombectomy (MT) for acute anterior circulation occlusion. METHODS: A database comprising consecutive registrations of patients who underwent mechanical thrombectomy for acute anterior circulation large vessel occlusive cerebral infarction at Nanjing Drum Tower Hospital from January 2018 to December 2021 was analyzed. Collateral circulation was assessed using the American Society of Interventional and Therapeutic Neuroradiology/Society of Interventional Radiology (ASITN/SIR) scoring criteria. The good collateral group included ASITN/SIR grades 3 and 4, while the poor collateral group included grades 1 and 2. Additionally, white matter hyperintensity burden was evaluated using white matter hyperintensity volume and the Fazekas scoring system. A favorable functional outcome was defined as a modified Rankin scale (mRS) of 0-2 at 90 days. Multivariable logistic regression analyses and Spearman correlation analysis were employed to assess the correlation between white matter hyperintensity burden and unfavorable outcomes in mechanical thrombectomy. RESULTS: A total of 123 patients who underwent mechanical thrombectomy for acute anterior circulation occlusion were included (56.9 % male). Favorable outcomes were observed in 45.5 % (56/123) of cases. Those with a low ASITN/SIR scale (r = -1.33, 95 % CI: 0.26 (0.09-0.78), P=0.01; cutoff value = 2.5), low low-density lipoprotein cholesterol (LDL-C) level (r = -1.00, 95 % CI: 0.37 (0.15-0.92), P=0.03; cutoff value = 2.26), and high white matter hyperintense volume (r = 0.28, 95 % CI: 1.33 (1.03-1.71), P=0.03; cutoff value = 10.03) were more likely to experience unfavorable outcomes. Moreover, when compared to ASITN/SIR scale (AUC=89.6, 95 % CI: 0.09-0.78) and LDL level (AUC=62.8, 95 % CI: 0.15-0.92), white matter hyperintense volume demonstrated greater accuracy in predicting poor outcomes (AUC=94.4, 95 % CI: 1.03-1.71). Importantly, white matter hyperintense volume showed a positive correlation with the modified Rankin Scale (mRS) Score (r = 0.8289, P<0.0001). In brief, the burden of white matter hyperintensity is negatively correlated with collateral circulation in mechanical thrombectomy for acute anterior circulation occlusion. CONCLUSIONS: The higher the burden of white matter hyperintensity, the worse the collateral circulation in mechanical thrombectomy for acute anterior circulation occlusion. The combination of high white matter hyperintensity volume and poor collateral circulation enhances might predict a worse clinical outcome of mechanical thrombectomy with acute anterior circulation occlusion.

12.
Heliyon ; 10(16): e36640, 2024 Aug 30.
Artigo em Inglês | MEDLINE | ID: mdl-39258188

RESUMO

The tyrosine kinase inhibitors (TKIs) have improved overall survival of CML (chronic myeloid leukemia) patients and allow them to experience normal life expectancy. However, relapse and drug resistance remain the main challenges in the clinical treatment of CML. The B-cell lymphoma 6 (BCL6) is essential to regulation of multiple function such as immune response and lymphomagenesis in lymph node germinal cells. Recent studies have shown that BCL6 is required for the maintenance of leukemia stem cells in CML, but the expression of Bcl-6 in response to Imatinib and the underlying mechanism are still unclear. Here, we found that BCL6 is expressed at high levels in primary CML bone marrow samples and CML TKI-resistance cell lines. CML cells with higher levels of BCL6 were generally sensitive to treatment with BCL6 inhibitors, BI-3812. Treatment of CML cells with BCL6 inhibitor and TKIs suggested enhanced anti-leukemia activity. In summary, our findings suggest BCL6 as a therapeutic target for the treatment of CML.

13.
Commun Biol ; 7(1): 1181, 2024 Sep 19.
Artigo em Inglês | MEDLINE | ID: mdl-39300259

RESUMO

A major driver of neuronal hyperexcitability is dysfunction of K+ channels, including voltage-gated KCNQ2/3 channels. Their hyperpolarized midpoint of activation and slow activation and deactivation kinetics produce a current that regulates membrane potential and impedes repetitive firing. Inherited mutations in KCNQ2 and KCNQ3 are linked to a wide spectrum of neurodevelopmental disorders (NDDs), ranging from benign familial neonatal seizures to severe epileptic encephalopathies and autism spectrum disorders. However, the impact of these variants on the molecular mechanisms underlying KCNQ3 channel function remains poorly understood and existing treatments have significant side effects. Here, we use voltage clamp fluorometry, molecular dynamic simulations, and electrophysiology to investigate NDD-associated variants in KCNQ3 channels. We identified two distinctive mechanisms by which loss- and gain-of function NDD-associated mutations in KCNQ3 affect channel gating: one directly affects S4 movement while the other changes S4-to-pore coupling. MD simulations and electrophysiology revealed that polyunsaturated fatty acids (PUFAs) primarily target the voltage-sensing domain in its activated conformation and form a weaker interaction with the channel's pore. Consistently, two such compounds yielded partial and complete functional restoration in R227Q- and R236C-containing channels, respectively. Our results reveal the potential of PUFAs to be developed into therapies for diverse KCNQ3-based channelopathies.


Assuntos
Canal de Potássio KCNQ3 , Simulação de Dinâmica Molecular , Mutação , Transtornos do Neurodesenvolvimento , Canal de Potássio KCNQ3/genética , Canal de Potássio KCNQ3/metabolismo , Humanos , Transtornos do Neurodesenvolvimento/genética , Transtornos do Neurodesenvolvimento/tratamento farmacológico , Ativação do Canal Iônico/efeitos dos fármacos , Animais , Células HEK293 , Potenciais da Membrana/efeitos dos fármacos
14.
PLoS One ; 19(9): e0308265, 2024.
Artigo em Inglês | MEDLINE | ID: mdl-39240910

RESUMO

Steganography, the use of algorithms to embed secret information in a carrier image, is widely used in the field of information transmission, but steganalysis tools built using traditional steganographic algorithms can easily identify them. Steganography without embedding (SWE) can effectively resist detection by steganography analysis tools by mapping noise onto secret information and generating secret images from secret noise. However, most SWE still have problems with the small capacity of steganographic data and the difficulty of extracting the data. Based on the above problems, this paper proposes image steganography without embedding carrier secret information. The objective of this approach is to enhance the capacity of secret information and the accuracy of secret information extraction for the purpose of improving the performance of security network communication. The proposed technique exploits the carrier characteristics to generate the carrier secret tensor, which improves the accuracy of information extraction while ensuring the accuracy of secret information extraction. Furthermore, the Wasserstein distance is employed as a constraint for the discriminator, and weight clipping is introduced to enhance the secret information capacity and extraction accuracy. Experimental results show that the proposed method can improve the data extraction accuracy by 10.03% at the capacity of 2304 bits, which verifies the effectiveness and universality of the method. The research presented here introduces a new intelligent information steganography secure communication model for secure communication in networks, which can improve the information capacity and extraction accuracy of image steganography without embedding.


Assuntos
Algoritmos , Redes de Comunicação de Computadores , Segurança Computacional , Processamento de Imagem Assistida por Computador/métodos
15.
J Oral Biosci ; 2024 Sep 06.
Artigo em Inglês | MEDLINE | ID: mdl-39245205

RESUMO

OBJECTIVE: To study the effects of losartan, an angiotensin II receptor blocker, in the SCC4 and SCC25 human tongue squamous cell carcinoma cell lines. METHODS: Cell proliferation was measured by MTS/PMS activity and trypan blue exclusion assays. The levels of the cell proliferation marker, cyclin D1, were analyzed by western blotting. Apoptosis was assessed by caspase-3 activation and Annexin V-FITC/propidium iodide double staining. Activation of epidermal growth factor receptor (EGFR) and ERK1/2 was validated by western blotting. RESULTS: Moderate concentrations of losartan enhanced the proliferation of SCC4 and SCC25 cells. However, high losartan concentrations induced apoptosis in SCC4 cells. Losartan activated the EGFR/ERK1/2/cyclin D1 signaling axis, which in turn promoted cell proliferation. Afatinib (EGFR inhibitor) and U0126 (ERK1/2 inhibitor) abolished losartan-induced cell proliferation. In contrast, UC2288 (p21 inhibitor) enhanced it. CONCLUSIONS: Losartan exhibited dual effects on tongue squamous cell carcinoma cells. Moderate losartan concentrations facilitated cell proliferation, whereas high concentrations induced cytotoxicity in tongue carcinoma cells.

16.
Heliyon ; 10(18): e37529, 2024 Sep 30.
Artigo em Inglês | MEDLINE | ID: mdl-39309858

RESUMO

Background: The incidence of muscle atrophy or sports injuries is increasing with time and population aging, thereby attracting considerable attention to muscle generation research. Muscle satellite cells, which play an important role in this process, lack comprehensive literature regarding their use for muscle regeneration. Hence, this study aimed to analyze the hotspots and trends in satellite cell research from 2010 to 2023, providing a reference for muscle regeneration research. Methods: Studies on satellite cells' role in muscle regeneration from 2010 to 2023 were retrieved from the Web of Science Core Collection. Using CiteSpace and VOSviewer, we analyzed annual publications, authors and co-citing authors, countries and institutions, journals and co-citing journals, co-citing references, and keywords. Results: From 2010 to 2023, 1468 papers were retrieved, indicating an overall increasing trend in the number of annual publications related to satellite cells in muscle regeneration. The United States had the highest number of publications, while the Institut National de la Santé et de la Recherche Médicale was the institution with the most publications. Among journals, " PloS One" had the highest number of published papers, and "Cell" emerged as the most co-cited journal. A total of 7425 authors were involved, with Michael A. Rudnicki being the author with the highest number of publications and the most co-cited author. The most cited reference was "Satellite cells and the muscle stem cell niche." Among keywords, "satellite cells" was the most common, with "heterogeneity" having the highest centrality. Frontier themes included "Duchenne muscular dystrophy," "skeletal muscle," "in-vivo," "muscle regeneration," "mice," "muscle atrophy," "muscle fibers," "inflammation," " mesenchymal stem cells," and "satellite cell." Conclusion: This study presents the current status and trends in satellite cell research on muscle regeneration from 2010 to 2023 using bibliometric analyses, providing valuable insights into numerous future research directions.

17.
Emerg Microbes Infect ; 13(1): 2408322, 2024 Dec.
Artigo em Inglês | MEDLINE | ID: mdl-39305009

RESUMO

Clostridioides difficile sequence type (ST) 35 has been found in humans and animals worldwide. However, its genomic epidemiology and clonal transmission have not been explored in detail. In this study, 176 C. difficile ST35 isolates from six countries were sequenced. Genomic diversity, clonal transmission and epidemiological data were analyzed. Sporulation and virulence capacities were measured. Four ribotypes (RT) were identified including RT046 (97.2%), RT656 (1.1%), RT427 (0.6%), and RT AI-78 (1.1%). Phylogenetic analysis of 176 ST35 genomes, along with 50 publicly available genomes, revealed two distinctive lineages without time-, region-, or source-dependent distribution. However, the distribution of antimicrobial resistance genes differed significantly between the two lineages. Nosocomial and communal transmission occurred in humans with the isolates differed by ≤ two core-genome single-nucleotide polymorphism (cgSNPs) and clonal circulation was found in pigs with the isolates differed by ≤ four cgSNPs. Notably, interspecies clonal transmission was identified among three patients with community acquired C. difficile infection and pigs with epidemiological links, differed by ≤ nine cgSNPs. Toxin B (TcdB) concentrations were significantly higher in human isolates compared to pig isolates, and ST35 isolates exhibited stronger sporulation capacities than other STs. Our study provided new genomic insights and epidemiological evidence of C. difficile ST35 intraspecies and interspecies clonal transmission, which can also be facilitated by its strong sporulation capacity.


Assuntos
Clostridioides difficile , Infecções por Clostridium , Genoma Bacteriano , Filogenia , Ribotipagem , Clostridioides difficile/genética , Clostridioides difficile/classificação , Clostridioides difficile/isolamento & purificação , Humanos , Animais , Infecções por Clostridium/transmissão , Infecções por Clostridium/microbiologia , Infecções por Clostridium/epidemiologia , Suínos , Polimorfismo de Nucleotídeo Único , Infecção Hospitalar/epidemiologia , Infecção Hospitalar/microbiologia , Infecção Hospitalar/transmissão , Epidemiologia Molecular , Virulência/genética , Proteínas de Bactérias/genética , Toxinas Bacterianas/genética , Genômica , Farmacorresistência Bacteriana/genética
18.
Microb Pathog ; 196: 106879, 2024 Nov.
Artigo em Inglês | MEDLINE | ID: mdl-39218372

RESUMO

Epinecidin-1 (Epi-1) is an antimicrobial peptide originated from fish with various pharmacological activities but carries the risk of acquiring resistance with long-term use. In the present study, we use L-lactic acid to enhance the antibacterial activity of synthesized Epi-1 against the aquaculture and food pathogen Aeromonas hydrophila. The results showed that 5.5 mmol/L lactic acid increased the inhibitory and bactericidal activity of 25 µmol/L Epi-1 against two strains of A. hydrophila. The laser confocal images proved that lactic acid pre-treatment improved the attachment efficiency of Epi-1 in A.hydrophila cells. In addition, lactic acid enhanced the damaging effect of Epi-1 on the cell membrane of A. hydrophila, evidenced by releasing more nucleic acids, proteins, and transmembrane pH ingredients decrease and electromotive force dissipation. SEM images showed that compared with the single Epi-1 treatment, the co-treatment of Epi-1 and lactic acid caused more outer membrane vesicles (OMVs) and more severe cell deformation. These findings proved that lactic acid could enhance the efficiency of Epi-1 against A. hydrophila and shed light on new aspects to avoid resistance of pathogens against Epi-1.


Assuntos
Aeromonas hydrophila , Antibacterianos , Peptídeos Catiônicos Antimicrobianos , Membrana Celular , Proteínas de Peixes , Ácido Láctico , Testes de Sensibilidade Microbiana , Aeromonas hydrophila/efeitos dos fármacos , Ácido Láctico/farmacologia , Ácido Láctico/metabolismo , Membrana Celular/efeitos dos fármacos , Antibacterianos/farmacologia , Peptídeos Catiônicos Antimicrobianos/farmacologia , Proteínas de Peixes/farmacologia , Proteínas de Peixes/metabolismo , Sinergismo Farmacológico , Animais , Peptídeos Antimicrobianos/farmacologia , Concentração de Íons de Hidrogênio
19.
J Phys Chem B ; 128(41): 9976-10042, 2024 Oct 17.
Artigo em Inglês | MEDLINE | ID: mdl-39303207

RESUMO

Since its inception nearly a half century ago, CHARMM has been playing a central role in computational biochemistry and biophysics. Commensurate with the developments in experimental research and advances in computer hardware, the range of methods and applicability of CHARMM have also grown. This review summarizes major developments that occurred after 2009 when the last review of CHARMM was published. They include the following: new faster simulation engines, accessible user interfaces for convenient workflows, and a vast array of simulation and analysis methods that encompass quantum mechanical, atomistic, and coarse-grained levels, as well as extensive coverage of force fields. In addition to providing the current snapshot of the CHARMM development, this review may serve as a starting point for exploring relevant theories and computational methods for tackling contemporary and emerging problems in biomolecular systems. CHARMM is freely available for academic and nonprofit research at https://academiccharmm.org/program.


Assuntos
Teoria Quântica , Simulação de Dinâmica Molecular , Software
20.
Chem Sci ; 2024 Aug 16.
Artigo em Inglês | MEDLINE | ID: mdl-39170717

RESUMO

The interface robustness and spatial arrangement of functional molecules on metallic nanomaterials play a key part in the potential applications of functional nano-objects. The design of mechanically stable and electronically coupled attachments with the underlying metal is essential to bring specific desirable properties to the resulting hybrid materials. In this context, rigid multipodal platforms constitute a unique opportunity for the controllable grafting of functionality. Herein, we provide for the first time an in-depth description of the interface between gold nanorods and a chemically-grafted multipodal platform based on diazonium salts. Thanks to Raman and X-ray photoelectron spectroscopies and theoretical modeling, we deliver insights on the structural and electronic properties of the hybrid material. More importantly, it allows for the accurate assignment of Raman bands. The combination of experimental and theoretical results establishes the formation of four carbon-gold anchors for the calix[4]arene macrocycle leading to the exceptional stability of the functionalized nano-objects. Our results lay the foundations for the future design of robust and versatile platforms.

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