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http://dx.doi.org/10.1021/acs.nanolett.3c05081 | DOI Listing |
J Chem Phys
September 2025
Laboratoire de Chimie Théorique, Sorbonne Université and CNRS, F-75005 Paris, France.
We develop the theory justifying the application of the density-based basis-set correction (DBBSC) method to double-hybrid approximations in order to accelerate their basis convergence. We show that, for the one-parameter double hybrids based on the adiabatic connection, the exact dependence of the basis-set correction functional on the coupling-constant parameter λ involves a uniform coordinate scaling by a factor 1/λ of the density and of the basis functions. Neglecting this uniform coordinate scaling corresponds essentially to the recent work of Mester and Kállay, J.
View Article and Find Full Text PDFNAR Genom Bioinform
September 2025
DNA Repair and Recombination Laboratory, St Vincent's Institute of Medical Research, Fitzroy VIC 3065, Australia.
Meiotic crossovers promote correct chromosome segregation and the shuffling of genetic diversity. However, the measurement of crossovers remains challenging, impeding our ability to decipher the molecular mechanisms that are necessary for their formation and regulation. Here we demonstrate a novel repurposing of the single-nucleus Assay for Transposase Accessible Chromatin with sequencing (snATAC-seq) as a simple and high-throughput method to identify and characterize meiotic crossovers from haploid testis nuclei.
View Article and Find Full Text PDFJ Dairy Sci
September 2025
Advance Image Processing Research Laboratory (AIPRL), Institute of Computer and Software Engineering, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan 64200, Pakistan.
Food contamination remains a serious global concern due to its health risks, with milk being one of the most commonly adulterated foods in developing countries such as Pakistan, India, and Bangladesh. Accurate detection of milk contamination is essential for ensuring consumer safety and maintaining food industry standards. This study explores both invasive and noninvasive approaches for contamination analysis.
View Article and Find Full Text PDFAdv Colloid Interface Sci
August 2025
Cracow University of Technology, Faculty of Chemical Engineering and Technology, Department of Biotechnology and Physical Chemistry, Warszawska 24, 31-155 Cracow, Poland; Photo4Chem, Lea 114, 30-133 Cracow, Poland; Photo HiTech Ltd., Bobrzyskiego 14, 30-348 Cracow, Poland. Electronic address: joanna
Silatranization, a specialized variant of silanization using silatrane compounds, is emerging as a powerful strategy to functionalize material surfaces. Compared to conventional silane coupling agents, silatranes exhibit remarkable hydrolytic stability and enhanced resistance to self-condensation, enabling controllable, water-independent formation of a polysiloxane self-assembled monolayer. This review critically examines the unique structure of silatranyl cages, emphasizing how the intramolecular N->Si bond and chelate effect modulate the silicon center's reactivity toward hydroxyl-decorated surfaces.
View Article and Find Full Text PDFSyst Biol
September 2025
Department of Biology, University of North Carolina at Chapel Hill, USA.
For many questions in ecology and evolution, the most relevant data to consider are attributes of lineage pairs. Comparative tests for causal relationships among traits like 'diet niche overlap', 'divergence time', and 'strength of reproductive isolation (RI)' - measured for pairwise combinations of related species or populations - have led to several groundbreaking insights, but the correct statistical approach for these analyses has never been clear. Lineage-pair traits are non-independent, but unlike the expected covariance among species' traits, which is captured by a phylogenetic covariance matrix arising from a given model, the expected covariance among lineage-pair traits has not been explicitly formulated.
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