Results 211 to 220 of about 380,898 (297)

Synergizing Virtual Screening and Zebrafish Models to Identify Resveratrol-Derived Antiaging Polyphenols. [PDF]

Pharmaceuticals (Basel)
Hernández-Silva D, Cabello C, Cayuela ML, Pérez-Sánchez H, Alcaraz-Pérez F.   +4 more
europepmc   +1 more source

In Situ X‐Ray Tomography and Acoustic Emission Monitoring of Damage Evolution in C/C‐SiC Composites Fabricated by Liquid Silicon Infiltration

Advanced Science, EarlyView.
This study investigates how the internal structure of fiber‐reinforced ceramic composites affects their resistance to damage. By combining 3D X‐ray imaging with acoustic emission monitoring during mechanical testing, it reveals how silicon distribution influences crack formation.
Yang Chen, Renato S. M. Almeida, Stefan Flauder, Guillaume Couégnat, Kamen Tushtev, Jürgen Horvath, Peter Wriggers, Kurosch Rezwan   +7 more
wiley   +1 more source

Ultra-large virtual screening unveils potent agonists of the neuromodulatory orphan receptor GPR139. [PDF]

Nat Commun
Cabeza de Vaca I, Trapkov B, Shen L, Vo DD, Zhang X, Yang Y, Pezeshki M, Zhang X, Bällgren F, Saleh A, Tarnovskiy AV, Radchenko DS, Moroz YS, Bräuner-Osborne H, Svenningsson P, Kihlberg J, Liu ZJ, Hauser AS, Carlsson J.   +18 more
europepmc   +1 more source

A Protein‐Centric Strategy Coupled with Match‐Between‐Run Glycoproteomics Enables Discovery of Robust Site‐Specific Glycan Biomarkers for Hepatocellular Carcinoma

Advanced Science, EarlyView.
In this study, a highly robust N‐glycoproteomics (HRN) platform with a newly developed match‐between‐run scheme is used for biomarker discovery. This study proposes a protein‐centric strategy to prioritize proteins susceptible to aberrant glycosylation.
Lei Liu, Taiheng Ma, Qi Liu, He Zhu, Zheng Fang, Jiahong Ma, Ting Yu, Yan Wang, Jiahua Zhou, Xiaoyan Liu, Yaqian Li, Zhimou Guo, Xinmiao Liang, Mingming Dong, Deguang Sun, Mingliang Ye   +15 more
wiley   +1 more source

Identification of bioactive phytoconstituents as promising ABL2 inhibitors using virtual screening and molecular dynamics simulation. [PDF]

Sci Rep
Elayyan AEM, Elasbali AM, Alanazi MAM, Shamsi A, Mohammad T.   +4 more
europepmc   +1 more source

Targeting the GPX4–FUNDC1 Interaction with Magnesium Lithospermate B Attenuates Sepsis‐Associated Lung Injury

Advanced Science, EarlyView.
The diagram depicts the endothelial‐protective mechanism of magnesium lithospermate B (MLB) in sepsis‐associated lung injury. MLB binds GPX4 at Gly79, disrupts its interaction with FUNDC1, prevents mitophagy‐mediated GPX4 degradation, restores mitophagic flux, reduces ROS, and limits ferroptosis.
Zhixi Li, Chang Liu, Zhaoxue Ma, Dongyou Zheng, Renkai Wang, Yongjing Yu, Guangmin Chen, Chenglong Li, Yue Bu, Hang Cao, Bing Zhang   +10 more
wiley   +1 more source

Virtual Screening of Phytochemicals From Medicinal Plants as Promising PDE5 Inhibitors Against Erectile Dysfunction. [PDF]

Food Sci Nutr
Boudou F, Berkane A, Belakredar A, Keziz A, Alsaeedi H, Murray BA, Bechelany M, Barhoum A.   +7 more
europepmc   +1 more source

Unveil Fundamental Graph Properties for Neural Architecture Search

Advanced Science, EarlyView.
This paper proposes NASGraph, a graph‐based framework that represents neural architectures as graphs whose structural properties determine performance. By revealing structure–performance relationships, NASGraph enables efficient neural architecture search with significantly reduced computation.
Zhenhan Huang, Tejaswini Pedapati, Pin‐Yu Chen, Chunheng Jiang, Jianxi Gao   +4 more
wiley   +1 more source

Consensus scoring-guided virtual screening identifies potent anti-saprolegniasis compounds targeting a P450 fusion protein. [PDF]

Front Microbiol
Ali MA, Javaid A, Muvva C, Arul Murugan N, Srivastava V.   +4 more
europepmc   +1 more source