Repurposing of compound libraries yields new inhibitors of NDM-1 metallo-β-lactamase with diverse zinc-binding moieties by Vid Kavaš, Philip Hinchliffe, Maša Zorman, Alen Krajnc, Matic Proj, Majda Golob, Martina Hrast Rambaher, James Spencer, Stanislav Gobec

“…This resulted in a compound (14a) with an IC50 of 20 μM, which crystallography shows binds to NDM-1 in two different poses. Using this structure as a starting point for in silico design, we developed a series of larger thiol-based compounds designed to occupy more space in the active site and to utilize other novel zinc-binding groups. …”
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Theoretical open-loop model of respiratory mechanics in the extremely preterm infant. by Laura Ellwein Fix, Joseph Khoury, Russell R Moores, Lauren Linkous, Matthew Brandes, Henry J Rozycki

“…However, this mode is often not successful in the extremely preterm infant in part due to their markedly increased chest wall compliance that does not provide enough structure against which the forces of inhalation can generate sufficient pressure. …”
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Investigating an Erupting Metric-decimetric Radio Depression and Its Physical Origin by B. T. Wang, X. Cheng, J. Y. Yan, C. Xing, W. T. Fu, L. Wu, L. Deng, A. L. Lan, Y. Chen, C. Wang, M. D. Ding

“…At the radio band, even though the filament is difficult to identify in its early phase, it rapidly became distinct and formed a continuous loop-like dark structure during the eruption, i.e., so-called radio depression. …”
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Different Fish Farming Patterns in Paddy Fields Substantially Impact the Bacterial Community Composition, Stability, and Assembly Processes in Paddy Water by Yiran Hou, Rui Jia, Linjun Zhou, Liqiang Zhang, Bing Li, Jian Zhu

“…The partitioned system considerably impacted the bacterial co-occurrence networks within the paddy water, with the planktonic bacterial co-occurrence network in rice cultivation area having more nodes (205) and edges (2085), and its robustness being significantly higher than that of other groups, resulting in a more complex and stable structure of the planktonic bacterial community. In addition, the partitioned system significantly promoted the contribution of stochastic processes to bacterial community assembly in the paddy water, with the main enhanced stochastic processes being homogenizing dispersal and drift. …”
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Integration of nontarget screening and QSAR modeling to identify novel butachlor transformation products of high priority in soil and water environment by Feng Chen, Chi Wu, Lan Zhang, Liangang Mao, Lizhen Zhu, Xingang Liu

“…Butachlor (BTR), a widely used chloroacetanilide herbicide in rice paddies worldwide, has raised concerns due to limited data on its environmental transformation products (TPs) and their ecotoxicological effects. …”
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Clouds Detection in Polar Icy Terrains: A Deformable Attention-Based Deep Neural Network for Multispectral Polar Scene Parsing by Shaojin Dong, Cailan Gong, Yong Hu, Long Cheng, Yang Wang, Fuqiang Zheng

“…DLACD-Net incorporates a nested U-shaped encoder–decoder structure and proposes DSACRSU at each encoding–decoding stage. …”
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Drought-induced shifts in cowpea rhizoplane bacterial communities across different vegetative and reproductive stages by Durga P.M. Chinthalapudi, Nisarga Kodadinne Narayana, Sujan Poudel, John P. Brooks, Shankar Ganapathi Shanmugam, Raju Bheemanahalli

“…Beta diversity results revealed that genotype and drought significantly influenced microbial community structure across growth stages. Proteobacteria dominated the root zone of the EpicSelect4 genotype, while UCR369 showed an increase in Actinobacteria under drought conditions. …”
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Isobutyrate Confers Resistance to Inflammatory Bowel Disease through Host–Microbiota Interactions in Pigs by Xiuyu Fang, Haiyang Liu, Junling Liu, Yongqing Du, Zihan Chi, Yiqi Bian, Xuan Zhao, Teng Teng, Baoming Shi

“…We established a model of dextran sulfate sodium-induced colitis in pigs, which have gastrointestinal structure and function similar to those of humans; we performed multiomic analysis to investigate the therapeutic effects and potential mechanisms of isobutyrate on IBD at both the animal and cellular levels and validated the results. …”
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Preliminary Analysis of a Novel Spaceborne Pseudo Tripe-Frequency Radar Observations on Cloud and Precipitation: EarthCARE CPR-GPM DPR Coincidence Dataset by Zhen Li, Shurui Ge, Xiong Hu, Weihua Ai, Jiajia Tang, Junqi Qiao, Shensen Hu, Xianbin Zhao, Haihan Wu

“…By integrating EarthCARE W-band doppler cloud radar observations with GPM Ku/Ka-band dual-frequency precipitation radar data, this study constructs a novel global “pseudo tripe-frequency” radar coincidence dataset comprising 2886 coincidence events (about one-third of the events detected precipitation), aiming to systematically investigating band-dependent responses to cloud and precipitation structure. …”
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Analysis of the dynamics of occupational morbidity and its consequences in Ukraine in comparison with other countries of the world by M.H. Prodanchuk, A.V. Basanets, O.P. Kravchuk, K.Y. Hashynova, V.A. Hvozdetskyy

“…The most common occupational diseases in Ukraine are diseases caused by dust exposure: pneumoconiosis, chronic bronchitis, COPD, which make up 39% of the occupational morbidity structure. The global indicator of Disability Adjusted Life Year (DALYs) from the occupational exposure factors in the world (5.1%) is 3 times higher than the similar one in Ukraine (1.53%). …”
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Genetic aspects of nonimmune hydrops fetalis by H. A. Sarkisyan, S. V. Dumova, E. I. Shabelnikova, A. A. Fadeeva, K. S. Zizyukina, I. Yu. Zyablova, A. P. Khokhlova, O. I. Savateeva, D. M. Muscherova, I. V. Zhuravleva

“…The prevalence of nonimmune hydrops fetalis, according to various data, ranges from 0.05 to 0.5%, or about 1:4000 live births. …”
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Women’s and girls’ sexual empowerment differs by geographical context: a population-based validation study by Shannon N. Wood, Jessica L. Dozier, Celia Karp, Funmilola M. OlaOlorun, Elizabeth Omoluabi, Rosine Mosso, Pierre Z. Akilimali, Simon Peter Sebina Kibira, Frederick Makumbi, Georges Guiella, Peter Gichangi, Anoop Khanna, Sani Oumarou, Caroline Moreau

“…Findings Final models confirm the theoretical structure of the sexual empowerment measure, including two- dimensions: “existence of choice” and “exercise of choice”, each comprised of three items, with moderate internal consistency ranging from 0.59 to 0.69. …”
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Genomic signal selection analysis reveals genes related to the lambing trait of Hotan sheep by XinKun Wang, Wei Li, QiaoYan Huang, HuiPing Sun, LeXiao Zhu, RuoHuai Gu, Feng Xing

“…To identify the population genetic structure and linkage disequilibrium associated with SLE and TLE traits, we employed two complementary genome selection signals: the interpopulation genetic differentiation index (FST) and nucleotide diversity. …”
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Epiphytic lichen as a bioindicator of air pollution across selected urban, suburban, and rural areas in Malaysia by Nur Syafiqah Abd Hakim, Asmida Ismail, Mohd Talib Latif, Faezah Pardi, Rosla Zamzuri, Sofia Khalid, Faeiza Buyong

“…A strong negative correlation between IAP and PM10 (r = -0.957) underscores the impact of fine particulates on lichen community structure. Environmental variables such as bark pH, temperature, and humidity also influenced species distribution but played a secondary role compared to air pollutants. …”
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Effects of Drought Stress on the Relationship Between Solar-Induced Chlorophyll Fluorescence and Gross Primary Productivity in a Chinese Cork Oak Plantation by Qingmei Pan, Chunxia He, Shoujia Sun, Jinsong Zhang, Xiangfen Cheng, Meijun Hu, Xin Wang

“…Physiological coupling strengthened the GPP-SIF relationship under drought, while canopy structure effects were negligible. Random forest and path analyses revealed that VPD was the key factor reducing the GPP-SIF correlation during drought. …”
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Impact of GABA and nutritional supplements on neurochemical biomarkers in autism: a PPA rodent model study by Altaf N. Alabdali, Abir Ben Bacha, Mona Alonazi, Sameera Abuaish, Ahmad Almotairi, Laila Al-Ayadhi, Afaf K. El-Ansary

“…Histopathology revealed that combination therapy mitigated neurodegenerative changes induced by PPA, preserving hippocampal cellular structure.ConclusionThis study demonstrated that combined therapy (GABA, probiotics, vitamin D3, and β-lactam) were more effective than GABA alone in enhancing neurochemical balance and lowering oxidative stress in a PPA-induced mouse model of autism, indicating promise for treating symptoms.…”
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The cultural adaptation and psychometric evaluation of the Mothers on Respect Index for Native Hawaiians and Pacific Islanders by Rebecca Delafield, Eunjung Lim, Ann Chang, Crystal VangTung, Jocelyn Howard, Adrienne Dillard, Sunny Chen, Princess Lei Ebbay, Joseph Keawe‘aimoku Kaholokula

“…The psychometric analyses identified a three-factor structure for the culturally adapted index and confirmatory factor analyses were employed to refine the measure. …”
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The professional careers of former Portuguese football players: a sociodemographic and professional approach by Eduardo Teixeira, Carlos Silva, Félix Romero, Mauro Miguel, António Vicente

“…Methodology: The sample consisted of 84 Portuguese former players (48.8 ± 8.2 years old) with at least 8 years of professional experience, who finished their careers between 1988 and 2018. Quantitative data was collected from a validated semi-structure interview guide. …”
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Crucial areas of the economic analysis of public cancer care by D. A. Andreev, K. I. Polyakova, A. A. Zavyalov, T. N. Ermolaeva, A. G. Fisun, A. D. Ermolaeva, V. A. Dubovtseva, T. E. Maksimova

“…In addition, we focused on significant studies conducted either on the national or international level.Results and discussion. In principle, the structure of total costs is determined by the health policy regarding the cancer care system. …”
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A systematic review of microsimulation models for skin cancer by Caroline G. Watts, Kirstie G. McLoughlin, Stephen Wade, Amelia K. Smit, H. Peter Soyer, Pablo Fernandez-Peñas, David C. Whiteman, Pascale Guitera, Gillian Reyes-Marcelino, Karen Canfell, Anne E. Cust, Michael Caruana

“…To inform the development and improvement of skin cancer focussed microsimulation models, we conducted a systematic review and narrative synthesis of published skin cancer models to assess the structure, parameterisation, and assumptions. Methods The electronic databases OVIDMedline including Embase and the Cost-Effectiveness Analysis (CEA) Registry were searched up to 7 May 2025. …”
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