keyword
https://read.qxmd.com/read/38683962/unraveling-the-role-of-deep-eutectic-solvents-with-varying-hydrogen-bond-acceptors-on-the-thermoresponsive-polymer-poly-n-isopropylacrylamide
#1
JOURNAL ARTICLE
Sanjay Mor, Ritu Yadav, Kavya Bhakuni, Pradeep Rawat, Meena Bisht, Nirmala Deenadayalu, Pannuru Venkatesu
Deep eutectic solvents (DESs) have emerged as promising tools for crafting polymeric materials across diverse domains. This study delves into the impact of a series of DESs on the phase behavior of poly( N -isopropylacrylamide) (PNIPAM) in aqueous environments, presenting compelling insights into their performance. Specifically, we explore the conformational phase behavior of PNIPAM in the presence of four distinct lactic acid (LA)-based DESs: LA-betaine (LA-BET), LA-proline (LA-PRO), LA-choline chloride (LA-CC), and LA-urea (LA-U)...
April 29, 2024: Journal of Physical Chemistry. B
https://read.qxmd.com/read/38683957/multifunctional-zincophilic-hydrogel-electrolyte-with-abundant-hydrogen-bonds-for-zinc-ion-capacitors-and-supercapacitors
#2
JOURNAL ARTICLE
Shuzhen Cui, Wenxing Miao, Xiangbing Wang, Kanjun Sun, Hui Peng, Guofu Ma
The new-generation flexible Zn-ion capacitors (ZICs) require multifunctionality and environmental adaptability for practical applications. This essentially means that hydrogel electrolytes are expected to possess superior mechanical properties, temperature resistance, and tunable interface properties to resist flexibility loss and performance degradation over a wide operating temperatures range. Herein, a multifunctional polyzwitterionic hydrogel electrolyte (PAM/LA/PSBMA) with wide operating temperatures, excellent tensile ability, high water retention, and self-adhesion is designed...
April 29, 2024: ACS Nano
https://read.qxmd.com/read/38683934/controlled-supramolecular-polymerization-via-bioinspired-liquid-liquid-phase-separation-of-monomers
#3
JOURNAL ARTICLE
Satyajit Patra, Sushmitha Chandrabhas, Shikha Dhiman, Subi J George
Dynamic supramolecular assemblies, driven by noncovalent interactions, pervade the biological realm. In the synthetic domain, their counterparts, supramolecular polymers, endowed with remarkable self-repair and adaptive traits, are often realized through bioinspired designs. Recently, controlled supramolecular polymerization strategies have emerged, drawing inspiration from protein self-assembly. A burgeoning area of research involves mimicking the liquid-liquid phase separation (LLPS) observed in proteins to create coacervate droplets and recognizing their significance in cellular organization and diverse functions...
April 29, 2024: Journal of the American Chemical Society
https://read.qxmd.com/read/38683878/bayesian-workflow-for-time-varying-transmission-in-stratified-compartmental-infectious-disease-transmission-models
#4
JOURNAL ARTICLE
Judith A Bouman, Anthony Hauser, Simon L Grimm, Martin Wohlfender, Samir Bhatt, Elizaveta Semenova, Andrew Gelman, Christian L Althaus, Julien Riou
Compartmental models that describe infectious disease transmission across subpopulations are central for assessing the impact of non-pharmaceutical interventions, behavioral changes and seasonal effects on the spread of respiratory infections. We present a Bayesian workflow for such models, including four features: (1) an adjustment for incomplete case ascertainment, (2) an adequate sampling distribution of laboratory-confirmed cases, (3) a flexible, time-varying transmission rate, and (4) a stratification by age group...
April 29, 2024: PLoS Computational Biology
https://read.qxmd.com/read/38683598/unravelling-performance-of-honeycomb-structures-as-drug-delivery-systems-for-the-isoniazid-drug-using-dft-d3-correction-dispersion-and-molecular-dynamic-simulations
#5
JOURNAL ARTICLE
Masoud Darvish Ganji, Hyunseok Ko, Saeed Jamehbozorgi, Mahmood Tajbakhsh, Sepideh Tanreh, Rosa Pahlavan Nejad, Mahboubeh Sepahvand, Mahyar Rezvani
In this study, the potential of aluminum nitride (h-AlN), boron nitride (h-BN) and silicon carbide (h-SiC) nanosheets as the drug delivery systems (DDS) of isoniazid (INH) was scrutinized through density functional theory (DFT) and molecular dynamic (MD) simulations. We performed DFT periodic calculations on the geometry and electronic features of nanosheets adsorbed with INH by the DFT functional (DZP/GGA-PBE) employed in the SIESTA code. In the energetically favorable model, an oxygen atom of the C-O group of the INH molecule interacts with a Si atom of the h-SiC at 2...
April 29, 2024: Physical Chemistry Chemical Physics: PCCP
https://read.qxmd.com/read/38683577/salt-induced-fmoc-tripeptide-supramolecular-hydrogels-a-combined-experimental-and-computational-study-of-the-self-assembly
#6
JOURNAL ARTICLE
Miryam Criado-Gonzalez, Mario Iván Peñas, Florent Barbault, Alejandro J Müller, Fouzia Boulmedais, Rebeca Hernández
Delving into the mechanism behind the molecular interactions at the atomic level of short-sequence peptides plays a key role in the development of nanomaterials with specific structure-property-function relationships from a bottom-up perspective. Due to their poor water solubility, the self-assembly of Fmoc-bearing peptides is usually induced by dissolution in an organic solvent, followed by a dilution step in water, pH changes, and/or a heating-cooling process. Herein, we report a straightforward methodology for the gelation of Fmoc-FFpY (F: phenylalanine; Y: tyrosine; and p: PO4 2- ), a negatively charged tripeptide, in NaCl solution...
April 29, 2024: Nanoscale
https://read.qxmd.com/read/38683486/development-of-novel-9h-carbazole-4h-chromene-hybrids-as-dual-cholinesterase-inhibitors-for-the-treatment-of-alzheimer-s-disease
#7
JOURNAL ARTICLE
Nissi Sharon, Vinod G Ugale, Pannala Padmaja, Deepak Lokwani, Chandradeep Salunkhe, Padmaja Shete, Pedavenkatagari Narayana Reddy, Prasad P Kulkarni
Alzheimer's disease (AD) is a neurodegenerative disease affecting mental ability and neurocognitive functions. Cholinesterase enzymes affect concentration of acetylcholine in the brain, leading to dementia. Thus, there is an urgent need to develop novel dual cholinesterase inhibitors as possible anti-AD drugs. Herein, we have designed and synthesized a novel series of 9H-carbazole-4H-chromenes 4(a-l) through a one-pot three-component reaction of salicylaldehydes (1), hydroxycarbazole (2) and N-methyl-1-(methylthio)-2-nitroethenamine (3) using triethylamine as a catalyst in ethanol...
April 29, 2024: Molecular Diversity
https://read.qxmd.com/read/38683484/assessing-trends-in-hospitalizations-for-breast-cancer-among-women-in-korea-a-utilization-of-the-korea-national-hospital-discharge-in-depth-injury-survey-2006-2020
#8
JOURNAL ARTICLE
Jieun Hwang, Jeong-Hoon Jang
OBJECTIVE: Breast cancer poses a significant health threat globally and particularly in Korea, where mortality rates have risen notably. In this study, we analyzed the characteristics of breast cancer patients discharged in Korea over the past 15 years and explored the association between comorbidities and treatment outcomes to propose effective strategies for managing cancer patients. Understanding these dynamics is vital for informing tailored management strategies and optimizing healthcare system sustainability...
April 29, 2024: Journal of Epidemiology and Global Health
https://read.qxmd.com/read/38683175/effect-of-terahertz-waves-on-the-aggregation-behavior-of-neurotransmitters
#9
JOURNAL ARTICLE
Meng-Qiu Li, Chen Chen, Yu-Qiang Ma, Hong-Ming Ding
Understanding the dynamics of neurotransmitters is crucial for unraveling synaptic transmission mechanisms in neuroscience. In this study, we investigated the impact of terahertz (THz) waves on the aggregation of four common neurotransmitters through all-atom molecular dynamics (MD) simulations. The simulations revealed enhanced nicotine (NCT) aggregation under 11.05 and 21.44 THz, with a minimal effect at 42.55 THz. Structural analysis further indicated strengthened intermolecular interactions and weakened hydration effects under specific THz stimulation...
April 29, 2024: Physical Chemistry Chemical Physics: PCCP
https://read.qxmd.com/read/38683108/biological-applications-of-lipoic-acid-based-polymers-an-old-material-with-new-promise
#10
REVIEW
Qing Yu, Zhiyue Fang, Shifang Luan, Lei Wang, Hengchong Shi
Lipoic acid (LA) is a versatile antioxidant that has been used in the treatment of various oxidation-reduction diseases over the past 70 years. Owing to its large five-membered ring tension, the dynamic disulfide bond of LA is highly active, enabling the formation of poly(lipoic acid) (PLA) via ring-opening polymerization (ROP). Herein, we first summarize disulfide-mediated ROP polymerization strategies, providing basic routes for designing and preparing PLA-based materials. PLA, as a biologically derived, low toxic, and easily modified material, possesses dynamic disulfide bonds and universal non-covalent carboxyl groups...
April 29, 2024: Journal of Materials Chemistry. B, Materials for Biology and Medicine
https://read.qxmd.com/read/38682889/10-year-variability-in-high-and-low-life-satisfaction-trajectories-post-traumatic-brain-injury-a-tbi-model-systems-study
#11
JOURNAL ARTICLE
Therese M O'Neil-Pirozzi, Mitch Sevigny, Shanti M Pinto, Flora M Hammond, Shannon B Juengst
PURPOSE: To determine how life satisfaction changes across the first 10 years following traumatic brain injury (TBI). METHODS: Participants included 1,941 individuals from the TBI Model Systems database with life satisfaction data at 1-, 5-, and 10-years post-TBI. Based on Satisfaction With Life Scale scores, individuals were characterized as having one of the five 10-year life satisfaction trajectories: 'Stable High,' 'Stable Low,' 'Increased to High,' 'Decreased to Low,' and 'Unstable...
April 29, 2024: Brain Injury
https://read.qxmd.com/read/38682862/redesigning-the-kinetics-of-lysozyme-amyloid-aggregation-by-cephalosporin-molecules
#12
JOURNAL ARTICLE
Shivani A Muthu, Afnaan Qureshi, Rahul Sharma, Ishita Bisaria, Suhel Parvez, Sonam Grover, Basir Ahmad
In lysozyme amyloidosis, fibrillar aggregates of lysozyme are associated with severe renal, hepatic, and gastrointestinal manifestations, with no definite therapy. Current drugs are now being tested in amyloidosis clinical trials as aggregation inhibitors to mitigate disease progression. The tetracycline group among antimicrobials in use is in phase II of clinical trials, whereas some macrolides and cephalosporins have shown neuroprotection. In the present study, two cephalosporins, ceftazidime (CZD) and cefotaxime (CXM), and a glycopeptide, vancomycin (VNC), are evaluated for inhibition of amyloid aggregation of hen egg white lysozyme (HEWL) under two conditions (i) 4 M guanidine hydrochloride (GuHCl) at pH 6...
April 29, 2024: Journal of Biomolecular Structure & Dynamics
https://read.qxmd.com/read/38682617/5-1%C3%A2-%C3%AE-m-ion-regulated-rigid-quasi-solid-electrolyte-constructed-by-bridging-fast-li-ion-transfer-channels-for-lithium-metal-batteries
#13
JOURNAL ARTICLE
Yangxi Liu, Suqing Wang, Weicheng Chen, Wenhan Kong, Shupei Wang, Haixing Liu, Li Ding, Liang-Xin Ding, Haihui Wang
An ultra-thin quasi-solid electrolyte (QSE) with dendrite-inhibiting properties is a requirement for achieving high energy density quasi-solid lithium metal batteries (LMBs). Here, a 5.1 μm rigid QSE layer is directly designed on the cathode, in which Kevlar (poly(p-phenylene terephthalate)) nanofibres (KANFs) with negatively charged groups bridging metal-organic framework (MOF) particles are served as a rigid skeleton and non-flammable deep eutectic solvent (DES) is selected to be encapsulated into the MOF channels, combined with in-situ polymerization to complete safe electrolyte system with high rigidness and stability...
April 29, 2024: Advanced Materials
https://read.qxmd.com/read/38682462/using-latent-class-analysis-to-identify-need-typologies-and-recidivism-likelihood-among-women-who-perpetrate-violence
#14
JOURNAL ARTICLE
Lauren Belyea, Shelley L Brown, Marilyn Van Dieten
Understanding the heterogeneity of women who engage in violence is critical to provide effective treatment and reduce the likelihood of recidivism. Existing typologies of women who engage in violence have been created using mixed methodological approaches; the field would benefit from replication using a quantitative clustering method-latent class analysis (LCA)-as it is arguably more objective than methods used to date. A LCA was conducted using archival data involving 3,773 justice-impacted women in Western Canada to identify unique subgroups of women who perpetrate violence...
April 29, 2024: Journal of Interpersonal Violence
https://read.qxmd.com/read/38682268/dynamic-changes-in-the-gut-microbiota-after-bismuth-quadruple-therapy-and-high-dose-dual-therapy-for-helicobacter-pylori-eradication
#15
RANDOMIZED CONTROLLED TRIAL
Jing Chen, Yan Zhang, Hanchen Min, Junli Zhi, Shuyun Ma, Hongxia Dong, Jingshuang Yan, Xiaoyan Chi, Xiaomei Zhang, Yunsheng Yang
BACKGROUND: A novel regimen with high-dose dual therapy (HDDT) has emerged, but its impact on the gut microbiota is not well understood. This study aimed to evaluate the impact of HDDT on the gut microbiota and compare it with that of bismuth quadruple therapy (BQT). METHODS: We enrolled outpatients (18-70 years) diagnosed with Helicobacter pylori infection by either histology or a positive 13 C-urea breath test (13 C-UBT) and randomly assigned to either the BQT or HDDT group...
2024: Helicobacter
https://read.qxmd.com/read/38682177/assessment-of-the-in-vitro-effects-of-folate-core-shell-conjugated-iron-oxide-nanoparticles-as-a-potential-agent-for-acute-leukemia-treatment
#16
JOURNAL ARTICLE
Ghada M Nasr, Osama M Thawabieh, Randa M Talaat, Mahmoud Moawad, Manal O El Hamshary
BACKGROUND AND OBJECTIVE: There is a growing need to comprehend the potential outcomes of nanoparticles (NPs) on human well-being, including their potential for detecting and treating leukemia. This study examined the role of iron folate core-shell and iron oxide nanoparticles in inducing apoptosis and altering the expression of the B-cell lymphoma 2 ( Bcl-2 ), Bcl-2 associated X-protein ( Bax ), and Caspase-3 genes in leukemia cells. METHODS: The obtained iron oxide and iron folate core-shell nanoparticles were analyzed using a variety of analytical techniques, including ultraviolet-visible (UV-Vis) absorption spectroscopy, Fourier transform infrared spectroscopy (FTIR), X-ray diffraction (XRD), dynamic light scattering (DLS), zeta potential, and transmission electron microscopy (TEM)...
April 23, 2024: Frontiers in Bioscience (Landmark Edition)
https://read.qxmd.com/read/38682173/relation-between-heart-rate-variability-and-spectral-analysis-of-electroencephalogram-in-chronic-neuropathic-pain-patients
#17
JOURNAL ARTICLE
John Rajan, Girwar Singh Gaur, Karthik Shanmugavel, Adinarayanan S
Chronic neuropathic pain (CNP) is a complex condition often arising from neural maladaptation after nerve injury. Understanding CNP complications involves the intricate interplay between brain-heart dynamics, assessed through quantitative electroencephalogram (qEEG) and heart rate variability (HRV). However, insights into their interaction in chronic pain are limited. Resting EEG and simultaneous electrocardiogram (lead II) of the participants were recorded for qEEG and HRV analysis. Correlations between HRV and qEEG parameters were calculated and compared with age, sex, and body mass index (BMI)-matched controls...
May 1, 2024: Korean Journal of Physiology & Pharmacology
https://read.qxmd.com/read/38682083/keeping-us-young-grandchild-caregiving-and-older-adults-cognitive-functioning
#18
JOURNAL ARTICLE
Jennifer Caputo, Kathleen A Cagney, Linda Waite
OBJECTIVE: This study investigates longitudinal associations between providing care to grandchildren and cognitive functioning. It also examines heterogeneity in these relationships. BACKGROUND: Grandchild caregiving may support older adults' cognitive functioning by providing social engagement and emotional meaning. However, studies caution that time- intensive or custodial grandchild caregiving can take a toll on grandparents. The cognitive health implications of grandchild caregiving may thus depend on contexts including time spent providing care and living arrangements...
June 2024: Journal of Marriage and the Family
https://read.qxmd.com/read/38682001/giant-thigh-lipomas-from-a-case-report-to-a-guide-for-the-surgical-approach
#19
Federico De Maria, Caterina Marra, Claudio Gio Francesco Blessent, Marta Starnoni, Marco Pappalardo, Giorgio De Santis
The issue of international migration and health has received increased attention since its rise due to empirical studies on the immigrant paradox. Less examined has been research focused on countries in the Global South with growing immigrant population share and contentious debates on implications. Using data from the longitudinal National Income Dynamics Study (NIDS) (2008-2017) and panel logistic regression this study focused on evaluating whether reported physical health, mental health, and life satisfaction are all associated with immigrant status in South Africa...
2024: Case Reports in Plastic Surgery & Hand Surgery
https://read.qxmd.com/read/38681859/transitioning-virtual-only-group-therapy-for-substance-use-disorder-patients-to-a-hybrid-model
#20
JOURNAL ARTICLE
Tyler S Oesterle, Nicholas L Bormann, Domenic A Ochal, Stephan Arndt, Scott A Breitinger
PURPOSE: Telehealth is associated with a myriad of benefits; however, little is known regarding substance use disorder (SUD) treatment outcomes when participants join group therapy sessions in a combination in-person and virtual setting (hybrid model). We sought to determine if treatment completion rates differed. PATIENTS AND METHODS: Policy changes caused by the COVID-19 pandemic created a naturalistic, observational cohort study at seven intensive outpatient (IOP) programs in rural Minnesota...
2024: Substance Abuse and Rehabilitation
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