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Federated Learning in Computational Toxicology: An Industrial Perspective on the Effiris Hackathon

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (9)

In silico approaches have acquired atoweringrole in pharmaceutical research and development, allowing laboratoriesall around the world to design, crea......

In Silico Prediction of Human Organ Toxicity via Artificial Intelligence Methods

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (7)

Unpredicted human organ level toxicity remains one ofthe majorreasons for drug clinical failure. There is a critical need for cost-efficientstrategies......

Investigating the Immune Basis of Green Tea Extract Induced Liver Injury in Healthy Donors Expressing HLA-B*35:01

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (12)

Epigallocatechin-3-O-gallate (EGCG) is the major component of green tea extract, commonly found in dietary supplements, and has been associated with i......

Impact of Chronic Exposure to Arsenate through Drinking Water on the Intestinal Barrier

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (11)

Chronic exposure to inorganic arsenic (As) [As(III) + As(V)], which affects millions of people, increases the incidence of some kinds of cancer and ot......

Machine Learning Enables Accurate Prediction of Quinone Formation during Drug Metabolism

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (12)

Metabolism helps in the elimination of drugs from the human body by making them more hydrophilic. Sometimes, drugs can be bioactivated to highly react......

LC-MS/MS Analysis of Reaction Products of Arginine/Methylarginines with Methylglyoxal/Glyoxal

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (11)

Methylglyoxal (MGO) and glyoxal (GO) are toxic alpha-dicarbonyl compounds that undergo reactions with amine containing molecules such as proteins and ......

Molecular Hydrogen: Emerging Treatment for Stroke Management

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (12)

Ischemic stroke is a major cause of death and disability worldwide. However, only intravenous thrombolysis using mechanical thrombectomy or tissue pla......

A Membrane Biophysics Perspective on the Mechanism of Alcohol Toxicity

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (6)

Motivations for understanding the underlying mechanismsof alcoholtoxicity range from economical to toxicological and clinical. On theone hand, acute a......

Chemical Exposure Highlighted without Any A Priori Information in an Epidemiological Study by Metabolomic FT-ICR-MS Fingerprinting at High Throughput and High Resolution

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (10)

Epidemiological studies aim to assess associations between diseases and risk factors. Such investigations involve a large sample size and require powe......

Electrophilic Reactivity of Sulfated Alcohols in the Context of Skin Sensitization

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 37 (1)

The surfactant sodium lauryl sulfate (SLS), although consistently positive in the murine local lymph node assay (LLNA) for skin sensitization, shows n......

Face Mask as a Versatile Sampling Device for the Assessment of Personal Exposure to 54 Toxic Compounds in Environmental Tobacco Smoke

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (7)

Exposure to environmental tobacco smoke (ETS), whichcontains hundredsof toxic compounds, significantly increases the risk of developingmany human dise......

Predicting the Mitochondrial Toxicity of Small Molecules: Insights from Mechanistic Assays and Cell Painting Data

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (7)

Mitochondrial toxicityis a significant concern in the drug discoveryprocess, as compounds that disrupt the function of these organellescan lead to ser......

Adenanthin Is an Efficient Inhibitor of Peroxiredoxins from Pathogens, Inhibits Bacterial Growth, and Potentiates Antibiotic Activities

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (4)

The emergence and re-emergence of bacterial strains resistant to multiple drugs represent a global health threat, and the search for novel biological ......

JAK3/STAT5b/PPAR? Pathway Mediates the Association between Di(2-ethylhexyl) Phthalate Exposure and Lipid Metabolic Disorder in Chinese Adolescent Students

期刊: CHEMICAL RESEARCH IN TOXICOLOGY, 2023; 36 (5)

Our previous studies found that di (2-ethylhexyl) phthalate (DEHP) could disorder lipid metabolism in adolescents but the mechanisms underlying this a......

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