Browse publications by year: 2025

  1. Searle BC, Chazarin B, Collins BC, Kundu DJ, Huang S, Lin Q, et al.
    J Proteome Res, 2025 Feb 07;24(2):381-382.
    PMID: 39916559 DOI: 10.1021/acs.jproteome.4c01098
  2. Chan JSW, Lau MS, Muhamad Rosli SH, Mustapha Kamal SK, Wan Seman WNN, Ali NH, et al.
    Ther Adv Chronic Dis, 2025;16:20406223241310206.
    PMID: 39917276 DOI: 10.1177/20406223241310206
    BACKGROUND: With rising obesity rates worldwide, clinical trials focused on identifying effective treatments are increasing. While guidelines exist for pharmaceutical drugs targeting obesity, there are none for herbal medicine clinical trials for anti-obesity. Both industries refer to the same guidelines for clinical trials.

    OBJECTIVES: This scoping review aimed to gather information from herbal medicine anti-obesity randomised controlled trials (RCTs), analyse the methodologies and assess their alignment with international guidelines.

    ELIGIBILITY CRITERIA: This review included RCTs of participants of all ages with obesity utilising herbal medicine with any comparators and focusing on various outcome measures.Sources of evidence: Only published journal articles were included.

    CHARTING METHODS: Articles were extracted from MEDLINE, CENTRAL and EMBASE using predetermined keywords. Relevant data, such as the study characteristics, types of herbal interventions and controls, treatment durations, outcome measures and safety monitoring methods were recorded in a table format for comparative analysis.

    RESULTS: We included 99 RCTs that showed participant sample sizes ranging from 8 to 182, ages 18 to 80 years and body mass indexes (BMIs) between 25 and 49.9 kg/m2. Herbal interventions used single herbs (n = 57) and mixtures (n = 42), given for 14 days to 56 weeks. Studies implementing diet modifications include restricted calorie diets (n = 35), food-portion controlled diets (n = 7) and fixed calorie diets (n = 7). Of the 28 studies implementing exercise, most were of moderate intensity (n = 22). All studies collected BMI and weight as primary outcomes. Body fat composition was measured in over 50% of studies using a body analyser (n = 57). Waist, hip and abdominal circumferences were infrequently measured. Radiological tools used include dual-energy X-ray absorptiometry (n = 16), computed tomography scans (n = 10) and ultrasound (n = 2). Safety monitoring methods were reported in most studies (n = 76).

    CONCLUSION: In conclusion, almost 50% of the studies adhered to international pharmaceutical clinical trial guidelines, addressing dietary, lifestyle, physical activity and cardiovascular risk factors. Nonetheless, more herbal anti-obesity studies need to consider the assessment of weight maintenance.

  3. Mansor NF, Abdul Halim Zaki I, Kiok LC, Seng EK, Ravi T, Pathmanathan M, et al.
    J Pharm Policy Pract, 2025;18(1):2449044.
    PMID: 39917475 DOI: 10.1080/20523211.2024.2449044
    INTRODUCTION: Thromboembolic (TE) complications in COVID-19 patients are rising globally, contributing significantly to mortality, particularly in severe cases. However, their prevalence, characteristics, and impact on mortality in Malaysia remain unclear.

    OBJECTIVES: This study aimed to determine the prevalence of thromboembolic (TE) events and associated mortality among COVID-19 patients admitted within a single centre intensive care unit (ICU). The proportions of patients with TE events who died, and factors associated with TE events were explored.

    METHODS: In this retrospective cohort study, patients with PCR confirmed SARS-CoV-2 virus and who received thromboprophylaxis within February 2020-2021 were included. TE event is a combination of venous [(deep vein thrombosis (DVT), pulmonary embolism (PE)] and arterial (myocardial infarction (MI), stroke) thromboembolism.

    RESULTS: Mean (SD) age 56.6 (13.7), 63.5% were male, 61.6% Malays, median (IQR) 7 (3-14) days of ICU stay, 64.2%, 53.2% and 20.9% had underlying hypertension, diabetes and obesity respectively. In total, 240 (44.9%) developed TE event. Significantly higher proportions of COVID-19 patients who developed complications of DVT (2.5% vs. 0.2%; p = 0.013), PE (47.5% vs 34.0%; p = 0.006), stroke (12.3% vs. 1.5; p<0.001) and MI (16.4% vs. 4.6%; p<0.001) died. Predictors of TE events were age [HR 1.01 (95% CI 1.00-1.02)], obesity [HR 1.98 (95% CI 1.51-2.6)], D-dimer [HR 1.01 (95% CI 1.00-1.01)], and duration of ICU stay [HR 0.98 (95% CI 0.97-0.99)].

    CONCLUSION: In severely ill COVID-19 patients, TE complications were common, and patients with DVT, PE, stroke, or MI faced increased mortality, even with thromboprophylaxis. Age, obesity, elevated D-Dimer levels, and longer ICU stays were significant predictors of TE events. Considering these findings, a more aggressive approach, combining thromboprophylaxis with enhanced anti-inflammatory treatments, may be necessary for high-risk COVID-19 ICU patients to reduce TE events and mortality.

  4. Kumar V, Singh M, Khatib MN, Balaraman AK, Roopashree R, Kaur M, et al.
    Expert Rev Respir Med, 2025 Feb 12.
    PMID: 39917855 DOI: 10.1080/17476348.2025.2464882
    BACKGROUND: Chronic obstructive pulmonary disease (COPD) is a leading cause of morbidity and mortality globally, particularly in low- and middle-income countries like India. This study aims to analyze regional trends and project future burden of COPD in India using data from the Global Burden of Disease (GBD) 1990-2021.

    METHODS: This analysis utilized data from the GBD study to assess age-standardized prevalence (ASPR), incidence (ASIR), disability-adjusted life years (DALYs) (ASDR), and mortality rates (ASMR) for COPD across Indian states. Joinpoint regression was used to analyze temporal trends, while ARIMA models predicted future incidence rates.

    RESULTS: In 2021, the highest ASIR was observed in Rajasthan at 306.28, and the highest ASMR was observed in Uttarakhand at 227.19. Projections suggest that the ASIR for COPD in India will decrease from 265.16 in 2022 to 258.19 by 2031. The heatmap analysis identified states like Uttarakhand and Rajasthan as having the highest DALYs attributable to COPD risk factors, including air pollution and tobacco use.

    CONCLUSION: COPD remains a public health challenge in India, with regional variability. Targeted interventions addressing air pollution, smoking cessation, and improved healthcare access are essential to mitigate the disease's future burden, particularly in high-risk regions.

  5. Qin Y, Huo S, González AM, Guo L, Santos J, Li L
    Curr Pharm Biotechnol, 2025 Feb 04.
    PMID: 39917929 DOI: 10.2174/0113892010325902241120111429
    OBJECTIVES: The aim of this study was to develop a clinical application model for the rational use of caffeine.

    BACKGROUND: Caffeine is related to the incidence of neuro immune gastrointestinal diseases. Coffee consumption needs to be optimized in order to reduce the incidence rate.

    PURPOSE: By using KEEG analysis to explore potential molecular signaling pathways involved in the progression of neurological immune gastrointestinal diseases, and analyzing the details of this signaling Pathway using molecular simulation results, which can support AI system for doctor.

    METHODS: The research team designed a controlled experiment to analyze the differences in reward and reinforcement of Brain pleasure/addiction and dopamine related signaling pathways function between multiple groups of people with different coffee drinking habits and a blank control group. The study team used molecular dynamics methods to investigate the signaling route that links coffee with the binding of dopamine receptor D3.AI is used to predict the prevalence of gastric reflux disease.

    RESULTS: Human experiments have shown a correlation between caffeine intake and gastroesophageal reflux disease. AI algorithm results can provide clinical support, and molecular simulation results are consistent with human experimental results. Caffeine and DRD3 protein have a stable interaction system.

    CONCLUSION: The research team elucidated the intermolecular interaction between caffeine and DRD3, and AI algorithms can predict the likelihood of disease occurrence, providing a new strategy for clinical practice. This study has passed ethical approval at Chifeng Cancer Hospital, and the ethical documents for this study have been submitted to the World Health Organization for filing.

  6. Mahlangu J, Mancuso ME, Fischer K, Djambas Khayat C, Carvalho M, Karim FA, et al.
    Haemophilia, 2025 Mar;31(2):214-223.
    PMID: 39917944 DOI: 10.1111/hae.15151
    INTRODUCTION: Clinical trials and real-world evidence have demonstrated the efficacy and safety of rVIII-SingleChain in previously treated patients with haemophilia A.

    AIM: To investigate the safety and efficacy of rVIII-SingleChain in previously untreated patients (PUPs).

    METHODS: In an open-label, phase 3, extension study, PUPs with severe haemophilia A (FVIII <1%) received rVIII-SingleChain prophylactically or on-demand. The primary endpoints were incidence of high-titre (HT) inhibitor formation to FVIII, treatment success for major bleeding episodes and annualised spontaneous bleeding rate (AsBR).

    RESULTS: Twenty-four PUPs (median age 1 year [range 0-5]) were treated with rVIII-SingleChain; median time on study was 35.0 months (range 2.4-54.0). Overall, six PUPs developed a HT inhibitor (>5 BU/mL) and six developed a low-titre (LT) inhibitor (≤5 BU/mL). The median number of exposure days at inhibitor development was 10 (interquartile range [IQR] 5.0-14.0). Of 11 inhibitor-positive PUPs (five HT, six LT) who continued rVIII-SingleChain therapy, nine (81.8%; three HT, six LT) achieved inhibitor eradication (<0.6 BU/mL). Median time to eradication was 14.3 weeks (IQR 9.8-53.8). Seventeen treatment-emergent adverse events in 12 PUPs (50.0%) were related to rVIII-SingleChain, mainly inhibitor development (14/17 events). Treatment was successful (haemostatic efficacy rated excellent or good) for 290/315 bleeding events (92.1%). During prophylactic therapy, inhibitor-negative PUPs had a median (IQR) AsBR of 0.52 (0.00-4.99) and annualised bleeding rate of 1.98 (0.77-11.23).

    CONCLUSION: RVIII-SingleChain demonstrated a satisfactory benefit:risk profile in PUPs, with a high treatment success rate and a low AsBR during prophylaxis, and was effective at eradicating inhibitors.

    MeSH terms: Child, Preschool; Female; Hemorrhage/prevention & control; Humans; Infant; Infant, Newborn; Male; Treatment Outcome
  7. Johnson CD, Green BN, Amorin-Woods LG, Arar I, Burnham KD, Byfield DC, et al.
    JBI Evid Synth, 2025 Apr 01;23(4):638-703.
    PMID: 39918018 DOI: 10.11124/JBIES-24-00122
    OBJECTIVE: This scoping review aimed to map the volume (number of studies) and nature (topics and designs) of chiropractic education research and scholarly publications on chiropractic learners and programs worldwide.

    INTRODUCTION: Despite the expansion of the chiropractic profession and its recognition by entities such as the World Health Organization, a gap exists in comprehending the international landscape of chiropractic education. No prior studies have systematically mapped the volume and nature of chiropractic education research and scholarly publications. A scoping review of chiropractic education research and scholarly publications is needed to guide future policy development, research agendas, and educational initiatives within the chiropractic profession.

    INCLUSION CRITERIA: Publications in the indexed literature on chiropractic students, graduates, academics, and programs in any chiropractic education setting were included. Studies focused on chiropractic programs and education for chiropractic students or chiropractors worldwide were considered for inclusion. All research designs, literature reviews, descriptive studies, and commentaries were included.

    METHODS: This scoping review was conducted according to JBI methodology for scoping reviews and was reported in line with the Preferred Reporting Items for Systematic reviews and Meta-Analyses extension for Scoping Reviews (PRISMA-ScR). The databases PubMed (NLM), Scopus, CINAHL via EBSCOhost, Index to Chiropractic Literature, Biblioteca Virtual em Saúde, and Educational Resources Information Center were searched from their inception to November 5 and 6, 2023, with no language limits. Data were extracted for primary topics, study designs, and regions of the included documents and entered in Covidence by paired independent reviewers. The findings were organized into figures and tables with a narrative description.

    RESULTS: The search identified 7494 documents. After deduplication, 5041 were screened for relevance, of which 667 were selected for full-text review. From these, 598 were selected for data extraction. The chiropractic education topics included values/ethical competence (n=3), personal/behavioral competence (n=34), knowledge and cognitive competence (n=49), functional and clinical competence (n=93), and program-relevant research (n=419). Most designs were quantitative (n=391), followed by descriptive reports (n=91), qualitative (n=43), mixed methods (n=40), commentaries (n=22), and literature reviews (n=11). Chiropractic education was most studied in the United States (n=359), Australia (n=116), and Canada (n=106).

    CONCLUSIONS: This scoping review reports the volume and nature of indexed publications relating to chiropractic learners and programs worldwide. This body of literature contains learner competencies in knowledge, skills, and attitudes, as well as studies about chiropractic programs. The increasing number of publications and proportion of study designs over time show that chiropractic scholars and programs are engaged in collecting, analyzing, and distributing data relevant to education and training. The map of professional competencies in the chiropractic education literature shows that the profession possesses the fundamental traits needed to contribute to the global health care workforce.

    REVIEW REGISTRATION: Open Science Framework https://osf.io/9b3ap.

    SUPPLEMENTAL DIGITAL CONTENT: French- [ http://links.lww.com/SRX/A94 ], Spanish- [ http://links.lww.com/SRX/A93 ] Mandarin- [ http://links.lww.com/SRX/A87 ], Portuguese- [ http://links.lww.com/SRX/A88 ], Malaysian- [ http://links.lww.com/SRX/A90 ], and Welsh-language [ http://links.lww.com/SRX/A89 ] translations of the abstract are available.

    MeSH terms: Education, Medical*; Humans; Research*
  8. Sihombing CA, Astuti SD, Arifianto D, Yaqubi AK, Zaidan AH, Nurdin DZI, et al.
    Lasers Med Sci, 2025 Feb 07;40(1):76.
    PMID: 39918643 DOI: 10.1007/s10103-025-04321-1
    This study aims to evaluate the efficacy of photodynamic therapy (PDT) using a 405 nm laser and two photosensitizers derived from silver nanoparticles, red onion extract, and shallot peel extract, comparing their effectiveness against Candida albicans. Candida albicans causes candidiasis, which requires effective, chemical-free treatment methods. PDT offers promise in this regard. The samples were divided into four groups: B1 (silver nanoparticles from red onion extract at concentrations of 1 mM, 1.5 mM, and 2 mM), A1 and A2 (fungus samples irradiated with a 405 nm laser at varying times and concentrations), and B2 (silver nanoparticles from shallot peel extract at the same concentrations). After each photosensitizer exposure, the fungi were subjected to radiation for 90-180 s. Following incubation, optical density (OD) was measured, and Tukey's Post Hoc Test (p 
    MeSH terms: Humans; Green Chemistry Technology
  9. Ab Ghani N, Maran S, Abdul Kadir MR, Somasundaram S, Raghavendran HRB, Kamarul Zaman T
    PMID: 39918759 DOI: 10.1080/09205063.2025.2460370
    In orthopaedic clinical applications, creating biocomposite bone substitutes to take the place of autologous bone transplants is still difficult. Studies have demonstrated for decades that poly (lactic-co-glycolic acid) [PLGA], a common polymer, has many benefits that make it a strong contender for bone replacement. These include biodegradability, good mechanical qualities, and the ability to induce new bone production. Although calcium-based materials are frequently used as bone fillers in bone implantation, the efficiency of ceramic materials containing calcium may be hampered by a number of issues, including low microporosity and quick rates of degradation. In order to overcome these obstacles, scientists are investigating ways to improve implant performance by combining PLGA with other materials, especially in terms of encouraging improved connections with nearby bone cells. An overview of the chemical properties of different PLGA-based scaffold composites, as well as the benefits and drawbacks of PLGA-Calcium implants in tissue engineering applications, are the goals of this review. It also highlights the possible advantages and consequences of using PLGA in 3D printing technology to improve bone tissue engineering clinical outcomes.
  10. Green ZA, Karuppannan G
    Psychol Rep, 2025 Feb 07.
    PMID: 39918974 DOI: 10.1177/00332941251317676
    This research demonstrates the construction and preliminary examination of the structure of a domain-specific measure, namely the Character Strengths Scale for University Students (CSSUS). Reflecting the use of the 24 Values in Action (VIA) strengths in the study domain, the CSSUS likely adds greater specificity to the findings pertinent for devising and implementing meaningful strategies for furthering academic development, student learning, and well-being in higher education. Derived from best practices, the item generation process of the CSSUS was based on four steps: (1) identification of the domain, (2) item generation, (3) content validity, and (4) field pre-testing of the items of the CSSUS. The initial examination of the factors of the CSSUS was based on a sample of 540 undergraduate and graduate students studying in Lahore, Pakistan. Results provided evidence of a four-factor structure of the CSSUS. Furthermore, the CSSUS and its subscales were positively related to academic achievement and the measures of satisfaction with life, positivity, and student self-efficacy. In addition, the CSSUS and its subscales were negatively related to the measure of academic burnout. The correlations provided evidence of the concurrent criterion-related validity of the scale. Moreover, female students reported higher levels of love and spirituality, whereas male students higher levels of leadership, creativity, and bravery. Also, there was no significant difference in the use of academic virtues with regard to gender, level of education (undergraduate and graduate), study discipline (agricultural sciences, humanities, health sciences, and engineering technology), type of university (public and private), and level of academic performance (low, medium, and high). The theoretical contribution and practice implications of the results are discussed. Limitations of the study and prospects for future research are also discussed.
  11. Tan LL, Mohamad NS, Hassan NI, Goh CT
    PLoS One, 2025;20(2):e0315974.
    PMID: 39919092 DOI: 10.1371/journal.pone.0315974
    Zinc has been demonstrated to boost immune response during SAR-CoV-2 infection, where it prevents coronavirus multiplication. Clinical investigations have testified to its beneficial effects on respiratory health and its deficiency may reduce immune function. A highly sensitive detection of Zn(II) ion via differential pulse voltammetry (DPV) utilizing an environmentally friendly modified screen-printed carbon electrode (SPCE) of electrochemically reduced graphene oxide (ErGO) embedded with carboxylated-8-carboxamidoquinoline (CACQ) as Zn(II) chelating ligand. The green CACQ/ErGO-modified SPCE was characterized by spectroscopy techniques, such as Fourier-transform infrared (FTIR) spectroscopy, Raman spectroscopy, and field-emission scanning electron microscopy with energy dispersive X-ray (FESEM-EDX). The modified electrode-solution interface was studied by electrochemical cyclic voltammetry (CV) and DPV methods. The CACQ-modified wrinkled ErGO electrode conferred a large surface-to-volume ratio with multiple binding sites resulting in greater opportunity for multiple dative covalent binding events with Zn(II) via coordination chemistry, and considerably accelerated the electron transfer rate at the electrode surface. The green Zn(II) sensor demonstrated a quick response time (60 s), broad linear range [1 pM-1 μM Zn(II) ion], a limit of detection (LOD) of 0.53 pM, 35 days of storage period (≥80% of its initial response retained), good reproducibility [relative standard deviation (RSD) = 3.4%], and repeatability (RSD = 4.4%). The developed electrode was applied to determine Zn(II) ion concentration in dietary supplement samples, and the results were in good agreement with those obtained from inductively coupled plasma-mass spectrometry (ICP-MS).
    MeSH terms: Electrodes*; Humans; Oxidation-Reduction; Quinolines/chemistry; Limit of Detection
  12. Panyushkina A, Matyushkina D, Pobeguts O, Muravyov M, Letarov A
    J Hazard Mater, 2025 May 05;488:137490.
    PMID: 39919630 DOI: 10.1016/j.jhazmat.2025.137490
    Mine waste disposal in dumps and stockpiles causes environmental pollution, particularly through microbe-assisted acid mine drainage (AMD) generation and groundwater contamination with hazardous heavy metal(loid)s. Metal hyper-resistance in acidophilic microorganisms remains an underexplored intriguing phenomenon. Using a multi-level approach, we provide the first data on extreme zinc resistance mechanisms in Sulfobacillus thermotolerans, recognized as one of the most metal-resistant organisms known. Under high zinc levels, Sb. thermotolerans cells exhibited efficient zinc sorption and low intracellular accumulation. Remarkably, mechanisms involved the upregulation of stress response and metabolic pathway proteins, including different GroEL chaperonin forms. Moreover, overexpression of the Sb. thermotolerans StGroEL chaperonin in Escherichia coli enhanced its growth and zinc resistance under zinc stress. 3D structure modeling and ion binding site prediction in StGroEL revealed 46 amino acid residues potentially involved in zinc docking. Thriving in natural and engineered environments, such as sulfide mines, mine waste disposal sites, and AMD, Sb. thermotolerans is a key member of acidophilic microbial communities used in commercial biotechnologies for sulfidic raw material processing. These findings, beyond their fundamental scientific relevance, have important implications for environmental protection, including AMD management, safe hazardous waste disposal, and a broader application of eco-friendly biomining technologies using metal-resistant microbial communities.
    MeSH terms: Bacterial Proteins/metabolism; Escherichia coli/drug effects; Escherichia coli/metabolism; Metals, Heavy/metabolism; Metals, Heavy/toxicity; Metals, Heavy/chemistry; Extremophiles/metabolism
  13. Goh ABH, Ling JG, Kamaruddin S, Murad AMA, Abu Bakar FD
    FEMS Microbiol Lett, 2025 Jan 10;372.
    PMID: 39919763 DOI: 10.1093/femsle/fnaf021
    Carboxylic acid reductases (CARs) have been garnering attention in applications for the sustainable synthesis of aldehydes. Despite numerous discoveries, not all characteristics of CAR enzymes have been extensively studied or understood. Herein, we report the discovery and expression of a new CAR enzyme (TvirCAR2) from the ascomycetous fungus, Trichoderma virens. Tvircar2 is one of the five putative CARs identified from analyses of the T. virens genome. In silico, analyses showed that TvirCAR2 has a high hydrophobicity index and that its corresponding gene is part of a biosynthetic gene cluster predicted to synthesize hybrid polyketide synthases-nonribosomal peptide synthetase secondary metabolites. TvirCAR2 was highly expressed as soluble and insoluble forms in an Escherichia coli expression host. The solubility of the purified TvirCAR2 necessitated the addition of glycerol in the purification and assay buffers. Substrate screening via molecular docking showed that benzoic acid was a suitable substrate candidate. The TvirCAR2 enzyme catalyzed the reduction of benzoic acid with a specific activity of around 1.4 µmol/h/mg. Homologs, which are predicted to exhibit similar hydrophobicity, are the CARs from Stachybotrys bisbyi (StbB), which is involved in the production of the meroterpenoid, ilicicolin B, and Trichoderma reesei (TrCAR), which is part of a similar but still uncharacterized biosynthetic gene cluster.
    MeSH terms: Escherichia coli/genetics; Escherichia coli/metabolism; Fungal Proteins/genetics; Fungal Proteins/metabolism; Fungal Proteins/chemistry; Multigene Family*; Substrate Specificity; Polyketide Synthases/genetics; Polyketide Synthases/metabolism; Polyketide Synthases/chemistry; Hydrophobic and Hydrophilic Interactions*; Molecular Docking Simulation
  14. Panliang M, Madaan S, Babikir Ali SA, J G, Khatibi A, Alsoud AR, et al.
    Sci Rep, 2025 Feb 07;15(1):4665.
    PMID: 39920157 DOI: 10.1038/s41598-025-85206-9
    Facial expression recognition (FER) has advanced applications in various disciplines, including computer vision, Internet of Things, and artificial intelligence, supporting diverse domains such as medical escort services, learning analysis, fatigue detection, and human-computer interaction. The accuracy of these systems is of utmost concern and depends on effective feature selection, which directly impacts their ability to accurately detect facial expressions across various poses. This research proposes a new hybrid approach called QIFABC (Hybrid Quantum-Inspired Firefly and Artificial Bee Colony Algorithm), which combines the Quantum-Inspired Firefly Algorithm (QIFA) with the Artificial Bee Colony (ABC) method to enhance feature selection for a multi-pose facial expression recognition system. The proposed algorithm uses the attributes of both the QIFA and ABC algorithms to enhance search space exploration, thereby improving the robustness of features in FER. The firefly agents initially move toward the brightest firefly until identified, then search transition to the ABC algorithm, targeting positions with the highest nectar quality. In order to evaluate the efficacy of the proposed QIFABC algorithm, feature selection is also conducted using QIFA, FA, and ABC algorithms. The evaluated features are utilized for classifying face expressions by utilizing the deep neural network model, ResNet-50. The presented FER system has been tested using multi-pose facial expression benchmark datasets, including RaF (Radboud Faces) and KDEF (Karolinska Directed Emotional Faces). Experimental results show that the proposed QIFABC with ResNet50 method achieves an accuracy of 98.93%, 94.11%, and 91.79% for front, diagonal, and profile poses on the RaF dataset, respectively, and 98.47%, 93.88%, and 91.58% on the KDEF dataset.
    MeSH terms: Algorithms*; Animals; Artificial Intelligence; Bees/physiology; Facial Expression*; Humans; Fireflies
  15. Pan J, Ng CL, Lim TS, Choong YS
    J Mol Model, 2025 Feb 08;31(3):77.
    PMID: 39920469 DOI: 10.1007/s00894-025-06298-8
    CONTEXT: S100 calcium-binding protein A9 (S100A9) is easily assembled into amyloid aggregates in solution. These amyloid aggregates cause retinal toxicity and act as an attachment core for Aβ fibrillar plaques that contribute to Alzheimer's disease progression. The overexpression of S100A9 is also noticed in various malignancies. Therefore, the S100A9 amyloid formation inhibition is of significant interest. In comparison with small-molecule drugs, short peptides demonstrate higher specificity, potency, and biosafety. Hence, it could be beneficial to identify potential peptides to inhibit or disrupt S100A9 amyloid aggregation. Typical peptide design and identification via experimental means requires extensive preparation procedures and is limited to random selection of peptides. Virtual screening therefore offers an unbiased, higher throughput, and economically efficient approach in peptide drug development. Here, we reported in silico pentapeptide design against S100A9 and studied the interaction of pentapeptide with S100A9 that leads to the binding of the peptide with S100A9.

    METHOD: Docking simulation resulted in three top binding free energy tripeptides (WWF, WPW, and YWF) with comparable affinity towards a known S100A9 inhibitor (polyphenol oleuropein aglycone; OleA). Subsequently, pentapeptides that consist of the three core tripeptides were selected from a pre-constructed pentapeptide library for further evaluation with docking simulation. Based on best docked binding free energy, two pentapeptides (WWPWH and WPWYW) were selected and subjected to 500 ns molecular dynamics (MD) simulation to study the important features that lead to the binding with S100A9. MMGBSA binding free energy calculation estimated - 30.38, - 24.58, and - 30.31 kcal/mol for WWPWH, WPWYW, and OleA, respectively. The main driving force for pentapeptide-S100A9 recognition was contributed by the electrostatic interaction. The results demonstrate that at in silico level, this workflow is able to design potential pentapeptides that are comparable with OleA and might be the lead molecule for future use to disaggregate S100A9 fibrils.

    MeSH terms: Binding Sites; Computer Simulation; Humans; Oligopeptides/metabolism; Oligopeptides/pharmacology; Oligopeptides/chemistry; Protein Binding; Drug Design; Molecular Dynamics Simulation; Molecular Docking Simulation*
  16. Prabhakar H, Lele AV, Kapoor I, Mahajan C, Shrestha GS, Rao CV, et al.
    Neurocrit Care, 2025 Feb 07.
    PMID: 39920547 DOI: 10.1007/s12028-025-02210-7
    BACKGROUND: This study aimed to assess the organization, infrastructure, workforce, and adherence to protocols in neurocritical care across low- and middle-income countries (LMICs), with the goal of identifying key gaps and opportunities for improvement.

    METHODS: We conducted a cross-sectional survey of 408 health care providers from 42 LMICs. The survey collected data on the presence of dedicated neurointensive care units, workforce composition, access to critical care technologies, and adherence to evidence-based protocols. Data were analyzed using descriptive statistics, and comparisons were made across different geographical regions (East Asia and the Pacific, Europe and Central Asia, Latin America and the Caribbean, the Middle East and North Africa, and South Asia and sub-Saharan Africa) and economic strata [low-income countries (LICs), lower middle-income countries (LoMICs), and upper middle-income countries (UMICs)].

    RESULTS: Only 36.8% of respondents reported access to dedicated neurointensive care units: highest in the Middle East (100%), lowest in sub-Saharan Africa (11.5%), highest in LoMICs (42%), and lowest in LICs (13%). Access to critical care technologies, such as portable computed tomography scanners (9.3%; UMICs 11%, LICs 0%) and tele-intensive care unit services (14.9%; UMICs 19%, LICs 10%), was limited. Workforce shortages were evident, with many institutions relying on anesthesia residents for 24-h care. Adherence to protocols, including those for acute ischemic stroke (61.7%) and traumatic brain injury (55.6%), was highest in Latin America and the Caribbean (72% and 73%, respectively) and higher in UMICs (66% and 60%, respectively) but remained low in LICs (22% and 32%, respectively).

    CONCLUSIONS: The study highlights critical gaps in infrastructure, workforce, and technology across LMICs, yet it also underscores the potential for improvement. Strategic investments in neurointensive care unit capacity, workforce development, and affordable technologies are an unmet need in resource-limited settings. These findings offer a road map for policymakers and global health stakeholders to prioritize neurocritical care and reduce the disparities in patient outcomes globally.

  17. Ang CPT, Ganthel K, Ho JPY, Devi K, Cheong JKY
    J Orthop Surg Res, 2025 Feb 07;20(1):145.
    PMID: 39920761 DOI: 10.1186/s13018-024-05443-y
    BACKGROUND: Achieving soft tissue balance is challenging in valgus arthritic knee because of a combination of anomalies in the soft tissues and bones. It has been stipulated that contemporary robotic systems are more precise than traditional instrumentation. Its advantage lies in the soft tissue algorithms. Presently, there is paucity of information on the use of robotic-assisted TKA in addressing moderate and severe valgus deformities. The aim of this series is to demonstrate the utility of robotic-assisted surgery in TKA for arthritic knees with moderate and severe valgus deformities, including accuracy, soft tissue releases performed and level of constraint required.

    METHODS: This is a single surgeon series of 14 cases of moderate and severe valgus osteoarthritic knees who underwent robotic-assisted TKA, utilizing the robotic surgical assistant ROSA® System.

    RESULTS: All patients were restored to within 3° of the planned alignment. 8 patients were implanted with cruciate retaining implants, 2 had ultracongruent implants, 3 had posterior stabilized implants, and 1 had a constrained posterior stabilized implant. No patients required release of the popliteus tendon or origin of the lateral collateral ligament. No perioperative complications were encountered in all cases. All patients reported an improvement in the Forgotten Joint Score of > 10.8 at 1year follow up with a 100% satisfaction rate.

    CONCLUSION: In this case series, the utilization of robotic assisted the surgeon to achieve a final limb alignment to within 3° of the planned alignment with minimal use of constrained prostheses and good patient-reported outcomes in moderate and severe valgus deformities.

    MeSH terms: Aged; Aged, 80 and over; Female; Humans; Knee Joint/surgery; Male; Middle Aged; Severity of Illness Index; Treatment Outcome
  18. Taha BA, Abdulrahm ZM, Addie AJ, Haider AJ, Alkawaz AN, Yaqoob IAM, et al.
    Talanta, 2025 May 15;287:127693.
    PMID: 39919475 DOI: 10.1016/j.talanta.2025.127693
    Multi-omics profiling integrates genomic, epigenomic, transcriptomic, and proteomic data, essential for understanding complex health and disease pathways. This review highlights the transformative potential of combining optical nanosensors with artificial intelligence (AI). It is possible to identify disease-specific biomarkers using real-time and sensitive molecular interactions. These technologies are precious for genetic, epigenetic, and proteomic changes critical to disease progression and treatment response. AI improves multi-omics profiling by analyzing large, diverse data sets and common patterns traditional methods overlook. Machine learning tools Biomarkers Discovery is revolutionizing, drug resistance is being understood, and medicine is being personalized as the combination of AI and nanosensors has advanced the detection of DNA methylation and proteomic signatures and improved our understanding of cancer, cardiovascular disease and vascular disease. Despite these advances, challenges still exist. Difficulties in integrating data sets, retaining sensors, and building scalable computing tools are the biggest obstacles. It also examines various solutions with advanced AI algorithms and innovations, including fabrication in nanosensor design. Moreover, it highlights the potential of nanosensor-assisted, AI-driven multi-omics profiling to revolutionize disease diagnosis and treatment. As technology advances, these tools pave the way for faster diagnosis, more accurate treatment and improved patient outcomes, offering new hope for personalized medicine.
    MeSH terms: Artificial Intelligence*; Humans; Nanotechnology; Proteomics/methods
  19. Latif MFA, Ghazali NNN, Rozali S, Badruddin IA, Kamangar S
    Comput Methods Programs Biomed, 2025 Apr;261:108610.
    PMID: 39919603 DOI: 10.1016/j.cmpb.2025.108610
    BACKGROUND AND OBJECTIVE: Obstructive sleep apnoea (OSA) is a prevalent sleep disease characterised by recurrent airway obstruction during sleep, resulting in diminished oxygen intake and disrupted sleep patterns. This study investigates the effectiveness of mandibular advancement surgery as a surgical intervention for obstructive sleep apnoea by analysing the postoperative alterations in turbulence kinetic energy (TKE).

    METHODOLOGY: The research involved five subjects receiving mandibular advancement surgery (MAS). The quantification of TKE was performed both before and throughout the method using a combination of computational fluid dynamics (CFD) models and empirical measurements. A suitable grid size of 2.6 million cells for CFD simulations was determined by grid sensitivity analysis and corroborated with physical measurements.

    RESULTS: The findings indicated a significant increase in TKE for each individual post-procedure, with increments varying from 23 % to 460 %. The elevated TKE indicates a more rapid airflow in the upper airway post-surgery. This is probably attributable to alterations in the airway's morphology resulting from the surgery. The observed rise in speed and turbulence is theoretically supported by Bernoulli's principle, which elucidates the relationship between air flow velocity and the pressure it generates.

    CONCLUSIONS: This study demonstrates that mandibular advancement surgery efficiently alleviates OSA by markedly enhancing airflow and diminishing turbulence in the upper airway post-treatment. The use of physical validation and grid sensitivity analysis in computational fluid dynamics simulations underscores the meticulous technique utilised, offering a comprehensive assessment of the efficacy of the surgical interventions for OSA.

    MeSH terms: Adult; Computer Simulation; Humans; Kinetics; Male; Middle Aged; Treatment Outcome; Hydrodynamics*
  20. Yeo YH, Lim GK, Mee XC, Ang QX, Tan MC
    Cardiovasc Revasc Med, 2025 Feb 01.
    PMID: 39919980 DOI: 10.1016/j.carrev.2025.01.013
    BACKGROUND: There is an increasing preference of utilizing valve-in-valve transcatheter aortic valve replacement (ViV TAVR) after bioprosthetic valve failure. However, updated large-scale analysis investigating early-mortality after the patients underwent ViV TAVR is limited.

    OBJECTIVE: This study aimed to assess in-hospital early mortality and analyze the factors associated with in-hospital early mortality among patients who underwent ViV TAVR.

    METHODS: Using the all-payer, nationally representative National Readmission Database, our study included patients aged 18 years or older who had ViV TAVR between 2017 and 2020. We categorized the cohort into two groups depending on the occurrence of in-hospital early mortality (death within 30 days after the procedure). Based on the ICD-10, we identified the trend of in-hospital early mortality after ViV TAVR and further analyzed the significant factors associated with it.

    RESULTS: After adjustment, a total of 11,009 patients who had ViV TAVR were included in this study. 329 (3.0 %) had in-hospital early mortality and 10,680 (97.0 %) without. There was a decreasing trend in in-hospital early mortality from 3.3 % in 2017 to 1.0 % in 2020, but it was insignificant (p = 0.71). In multivariable analysis, the independent factors associated with in-hospital early mortality were chronic liver disease (adjusted odds ratio [aOR]: 3.62; 95 % confidence interval [CI]: 1.96-6.71, p 

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