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1. QM assisted ML for ¹⁹F NMR chemical shift prediction

   Background

   Ligand-observed 19F NMR detection is an efficient method for screening libraries of fluorinated molecules in fragment-based drug design...

   Patrick Penner, Anna Vulpetti in Journal of Computer-Aided Molecular Design

   Article 12 December 2023
   

2. Relationship between radium isotopes and their chemical analogues in a hot spring area in Taiwan

   A gamma-ray spectrometry was used to measure radium isotopes in a radium-enriched hot spring area. The activity of ²²⁴ Ra was highly correlated with ²²⁸ ...

   Feng-Yun J. Huang, Feng-Chih Chang, ... Jiunn-Hsing Chao in Journal of Radioanalytical and Nuclear Chemistry

   Article 14 February 2024
   

3. The wastewater micropollutant carbamazepine in insectivorous birds—an exposure estimate

   Insects with aquatic life stages can transfer sediment and water pollutants to terrestrial ecosystems, which has been described for metals,...

   Anna-Jorina Wicht, Katharina Heye, ... Carolin Huhn in Analytical and Bioanalytical Chemistry

   Article Open access 17 May 2022
   

4. Experimental and Theoretical Study of the Interaction of a Low-Energy Ion Flow with Chemical Fibers

   Abstract

   Modern methods of modification of chemical fibers (CF) and fibrous materials on their basis, first of all, chemical methods of treatment, in...

   I. S. Abdullin, V. S. Zheltuhin, ... F. R. Sagitova in High Energy Chemistry

   Article 08 September 2023
   

5. Quantum-Chemical Study of Formation of Alkyl- and Alkenyladamantanes by Ionic Alkylation with Olefins

   Abstract

   The thermodynamic parameters of formation reactions (total energy at 0 K, enthalpy, and Gibbs free energy at a temperature of 298.15 K and a...

   N. I. Baranov, E. I. Bagrii, ... A. L. Maksimov in Kinetics and Catalysis

   Article 01 April 2024
   

6. Application of metal–organic frameworks in novel sample pretreatment techniques for occupational exposure biomonitoring: a review

   The declining trend in occupational exposure levels aimed to biomonitoring highlighted issues regarding sensitivity of analytical method and prompted...

   Samaneh Salari, Fatemeh Dehghani, ... Seyed Jamaleddin Shahtaheri in Chemical Papers

   Article 22 August 2023
   

7. Chemical strategies to engineer hydrogels for cell culture

   Two-dimensional and three-dimensional cell culture systems are widely used for biological studies, and are the basis of the organoid, tissue...

   Junzhe Lou, David J. Mooney in Nature Reviews Chemistry

   Article 30 August 2022
   

8. Muslin Deweaving through Combined Mechanical, Thermal and Chemical Methods

   Fabric waste has become an escalating problem that stems from the ever-shortening clothing lifecycle. Previous cotton recycling processes used...

   Hang Zhang Cao, Yiqian Yao, ... Tae** Kim in Fibers and Polymers

   Article 07 October 2022

9. Single-atom-mediated electron islands boost photocatalytic CO₂ chemical fixation

   Photocatalytic cycloadditions of CO ₂ with epoxides are emerging as a significant platform for the green synthesis of valuable carbonates, where...

   Shu Shang, Lei Li, ... Yi **e in Science China Chemistry

   Article 13 June 2024

10. Chemical characterization of virgin and recycled polyethylene terephthalate films used for food contact applications

    Plastic is commonly used for food packaging, of which plastic polymer polyethylene terephthalate (PET) is widely used in the food and beverage...

    Bina Bhattarai, Yukihiro Kusano, ... Gitte Alsing Pedersen in European Food Research and Technology

    Article Open access 22 November 2023
    

11. Exploring chemical space in non-targeted analysis: a proposed ChemSpace tool

    Non-targeted analysis (NTA) using high-resolution mass spectrometry allows scientists to detect and identify a broad range of compounds in diverse...

    Gabrielle Black, Charles Lowe, ... Tom Young in Analytical and Bioanalytical Chemistry

    Article 26 November 2022
    

12. Additive Manufacturing as the Future of Green Chemical Engineering

    Chemical sciences and engineering have made outstanding contributions in fulfillment of the needs of our technological society and upliftment of...

    Sunil Mehla, Ravindra D. Gudi, ... Suresh K. Bhargava in Additive Manufacturing for Chemical Sciences and Engineering

    Chapter 2022
    

13. Triggered metabolism of adenosine triphosphate as an explanation for the chemical heterogeneity of heterotopic ossification

    Heterotopic ossification (HO), the pathological formation of bone in soft tissues, is a debilitating condition, as well as one of the few instances...

    Cong Sui, Thomas E. Robinson, ... Liam M. Grover in Communications Chemistry

    Article Open access 19 October 2023
    

14. Evaluation of Chemical Risks Management During Handling Operations and Determination of Storage Conditions in Scientific Laboratories

    The use of chemicals is an integral part of the research and learning process in many university laboratories. Hazardous chemicals can only be...

    Hajar Housni, Karima Bendahhou, ... Nadia Tahiri Jouti in Chemistry Africa

    Article 14 November 2022
    

15. Extraction evaluation and chemical characterization of ginger oleoresins; a functional food ingredient

    Ginger oleoresins being rich in coloring, flavoring and other phytochemical compounds have strong potential for industrial applications. In this...

    Muhammad Subtain, Imran Pasha, ... Amer Jamil in Journal of Food Measurement and Characterization

    Article 17 April 2024
    

16. Chemical Stability of Hybrid Materials Based on Nafion® Membrane and Hydrated Oxides

    Abstract

    Improvement of the chemical stability of hybrid membranes based on perfluorosulfonic acid polymers is necessary to increase the lifetime of...

    E. Yu. Safronova, O. V. Korchagin, ... A. B. Yaroslavtsev in Membranes and Membrane Technologies

    Article 26 December 2022
    

17. Structural mechanism for specific binding of chemical compounds to amyloid fibrils

    Amyloid fibril is an important pharmaceutical target for diagnostic and therapeutic treatment of neurodegenerative diseases. However, rational design...

    Youqi Tao, Wencheng **a, ... Cong Liu in Nature Chemical Biology

    Article 03 July 2023
    

18. Chemical compounds and bioactivities of the extracts from radish (Raphanus sativus) sprouts exposed to red and blue light-emitting diodes during cultivation

    Radish ( Raphanus sativus ) is one of the cruciferous vegetables containing high amounts of glucosinolates and phenolic compounds. The major...

    Christopher Chen, Ryun Hee Kim, ... Jaecheol Kim in European Food Research and Technology

    Article 26 March 2023
    

19. Wearable chemical sensors for biomarker discovery in the omics era

    Biomarkers are crucial biological indicators in medical diagnostics and therapy. However, the process of biomarker discovery and validation is...

    Juliane R. Sempionatto, José A. Lasalde-Ramírez, ... Wei Gao in Nature Reviews Chemistry

    Article 15 November 2022
    

20. Metal–Organic Frameworks (MOFs) as Versatile Detoxifiers for Chemical Warfare Agents (CWAs)

    Chemical warfare agents (CWAs) are considered as one of the most fatal weapons potentially strong to cause extreme toxicity and disastrous effects to...

    Laishram Saya, Sunita Hooda in Metal-Organic Frameworks (MOFs) as Catalysts

    Chapter 2022