Results 71 to 80 of about 1,302,906 (282)

An integrative framework for prioritizing high-risk chemicals in children and adolescents: elevated blood pressure as a proof-of-concept

npj Emerging Contaminants
Environmental chemical mixtures pose a major challenge for outcome-specific chemical prioritization, particularly in vulnerable populations. Here, we analyzed serum levels of 97 chemicals in 1179 children and adolescents and developed a multidimensional ...
Ming Li, Lipan Wang, Mingye Zhang, Shiyu Shi, Zhixian Lv, Yun Tao, Jiawei Kang, Bin Zhou, Liqin Hu, Lulu Song, Youjie Wang, Surong Mei   +11 more
doaj   +1 more source

Computational identification of potential dengue RdRp inhibitors through docking, ADMET, and molecular dynamics

In Silico Research in Biomedicine
Dengue fever, caused by the dengue virus (DENV), remains a significant global health threat due to the lack of specific antiviral treatments or vaccines.
Hari Priya Narra, Venkata Monika Sarvani Atmakuri, Geethanjali Mandalapu, Shraddha Bhaskarani, Jyotsna Bandi, Garlapati Sujitha, Sudheer Kumar Katari, Anand Kumar Nelapati   +7 more
doaj   +1 more source

A New Bioactive Glass‐Based Hybrid Bioink With Enhanced Cell Viability and Antibacterial Properties

Advanced Healthcare Materials, EarlyView.
Graphical illustration of the production and characterization process, demonstrating the multiple functions of the new hybrid gelatin methacryloyl‐silver‐bioactive glass (GAB) material. Created in https://BioRender.com. ABSTRACT Recent advances in three‐dimensional bioprinting (3DBP) technology enable the production of customized bone substitutes ...
Adam C. Marsh, Ehsanul Hoque Apu, Theofania Kleisoura, Romila Manchanda, Valerie Johnson, Ginger Ross, Ioannis Tsamesidis, Eleana Kontonasaki, DeMarcus Bunn, Ahmet Erdem, Neal D. Hammer, Kurt D. Hankenson, Christopher H. Contag, Nureddin Ashammakhi, Xanthippi Chatzistavrou   +14 more
wiley   +1 more source

Excuse me, there is a mutant in my bioactivity soup! A comprehensive analysis of the genetic variability landscape of bioactivity databases and its effect on activity modelling [PDF]

Bioactivity prediction is essential in computational drug discovery, particularly within virtual screening campaigns. Despite advancements in model architectures and features, the sparsity and quality of relevant training data remain a major bottleneck ...
Olivier J. M., Béquignon, Anna, Gaulton, Gerard J. P., van Westen, Prudence, Mutowo, Marina, Gorostiola González, Barbara, Zdrazil, Andrew R., Leach, Elisabeth, Dawson, Emma, Manners, Laura H., Heitman, Adriaan P., IJzerman   +10 more
core   +1 more source

Elucidating molecular mechanism and chemical space of chalcones through biological networks and machine learning approaches

Computational and Structural Biotechnology Journal
We developed a bio-cheminformatics method, exploring disease inhibition mechanisms using machine learning-enhanced quantitative structure-activity relationship (ML-QSAR) models and knowledge-driven neural networks.
Ajay Manaithiya, Ratul Bhowmik, Satarupa Acharjee, Sameer Sharma, Sunil Kumar, Mohd. Imran, Bijo Mathew, Seppo Parkkila, Ashok Aspatwar   +8 more
doaj   +1 more source

Computational Evaluation of ADMET Properties and Bioactive Score of Compounds from Encephalartos ferox [PDF]

Pharmacognosy Journal, 2020
Tsolanku Sidney Maliehe, Phakamani Hopewell Tsilo, Jabulani Siyabonga Shandu   +2 more
openaire   +1 more source

Microfluidic Nano‐Assembly of Red‐Blood‐Cell (RBC) Lipids and Components for Engineering Extracellular Vesicles

Advanced Healthcare Materials, EarlyView.
Engineered red blood cell‐derived extracellular vesicles (eRBCEVs) are synthesized via controlled microfluidic assembly from native RBC lipids, enabling tunable encapsulation of proteins, nucleic acids, nanoparticles, and viral vectors. The platform demonstrates reproducible nanoscale architecture, preserved membrane composition, and functional cargo ...
Chiranth K. Nagaraj, Xilal Y. Rima, Kim T. Nguyen, Courtney Culkins, Nana Boateng, Jacob Doon‐Ralls, Alejandro Bresolin, Xin Huang, Hong Li, Vahedi Amid, Ajeet Pal Singh, Dharti Shantaram, Anastasiia Amari, Mangesh D. Hade, Nicholas R. Merriam, Zachary D. Schultz, Scott Q. Harper, Nizar Y. Saad, Setty M. Magaña, Willa A. Hsueh, Rachel E. Kopec, Blaise R. Kimmel, Andre F. Palmer, Eduardo Reátegui   +23 more
wiley   +1 more source

Peptide hormones and lipopeptides: from self-assembly to therapeutic applications [PDF]

, 2017
This review describes the properties and activities of lipopeptides and peptide hormones and how the lipidation of peptide hormones could potentially produce therapeutic agents combating some of the most prevalent diseases and conditions.
Hamley, I. W., Hutchinson, J. A., Burholt, S.   +2 more
core   +1 more source

Predicting functional bioactivities in fermented milk using deep learning on liquid chromatography-mass spectrometry metabolomics

Journal of Dairy Science
: Fermented dairy products are increasingly valued not only for their nutritional content but also for their potential health-promoting properties. However, assessing these functional benefits often requires time-consuming chemical assays that limit ...
Falah Awwad, Ghassan Al-Sumaidaee, Aya Eltayeb, Meera Saif Sultan Almazrouei, Tasnim Abdrabou, Mutamed M. Ayyash   +5 more
doaj   +1 more source

Hydrogels Augmented With Artificial Sweeteners can Inhibit Multidrug‐Resistant Acinetobacter baumannii Growth and Biofilm Formation While Demonstrating Safety in Pre‐Clinical Pilot Human Trials

Advanced Healthcare Materials, EarlyView.
Using PVA–borax hydrogels as carriers for off‐the‐shelf artificial sweeteners to fight multidrug‐resistant A. baumannii. These soft, biocompatible hydrogels rapidly reduce bacterial viability within multidrug‐resistant A. baumannii biofilms by more than 99% within one hour and sustain antimicrobial activity over time, while demonstrating safety in both
Jie Han, Mohamed Soliman, Bin Zhang, Dominika Krawiel, Ronan R. McCarthy   +4 more
wiley   +1 more source