Frontiers in Chemistry

Original Research

Published on 22 May 2025

Design of novel pyrazole and benzofuran-based derivatives as potent acetylcholinesterase inhibitors for Alzheimer’s disease management

in Theoretical and Computational Chemistry

Mohamed El Fadili
Amine Ez-Zoubi
Mourad Aloui
Somdutt Mujwar
Hatem A. Abuelizz
Menana Elhalaoui
Adnan Amin

Frontiers in Chemistry

doi 10.3389/fchem.2025.1614462

5,329 views

Original Research

Published on 22 May 2025

Inhibitory effect of Fisetin against the aggregation process of SOD1 E100K mutant: computer-based drug design as a potential therapeutic for ALS disease

in Theoretical and Computational Chemistry

Fatemeh Sadat Seyedi Asl
Nasrin Malverdi
Fatemeh Sadat Ataei Kachouei
Fatemeh Zarei
Shamim Ghiabi
Payam Baziyar
Mohsen Nabi-Afjadi

Frontiers in Chemistry

doi 10.3389/fchem.2025.1569777

3,141 views
10 citations

Original Research

Published on 21 May 2025

Synthesis and characterization of thymol-derived phenoxy acetamide derivatives using DFT, molecular docking, and parasitological investigations

in Medicinal and Pharmaceutical Chemistry

Ahmed R. Rabee
Saied M. Soliman
Hamida Abdel-Hamid
Esraa A. Moneer
Sara H. Akl
Yahya H. Shahin
Aliaa A. Masoud
Doaa Ahmad Ghareeb
Mariusz Jaremko
Abdul-Hamid Emwas

Frontiers in Chemistry

doi 10.3389/fchem.2025.1579923

13,814 views

Original Research

Published on 21 May 2025

Exploring the application of the microbial pigment violacein as a sustainable probe molecule for recycled paper-based SERS substrates

in Green and Sustainable Chemistry

Alessia Tropea
Donatella Spadaro
Dario Giuffrida
Sebastiano Trusso
Daniele Giuffrida
Tania Maria Grazia Salerno
Julio Montanez
Lourdes Morales-Oyervides
Luigi Mondello
Rosina Celeste Ponterio

Frontiers in Chemistry

doi 10.3389/fchem.2025.1571986

2,244 views

Correction

Published on 20 May 2025

Corrigendum: Viral mimicry as a design template for nucleic acid nanocarriers

in Nanoscience

Ina F. de la Fuente
Shraddha S. Sawant
Mark Q. Tolentino
Patrick M. Corrigan
Jessica L. Rouge

Frontiers in Chemistry

doi 10.3389/fchem.2025.1624509

1,192 views

Original Research

Published on 19 May 2025

Engineering of antimicrobial peptide Brevinin-1pl: arginine, lysine, and histidine substitutions enhance antimicrobial-anticancer efficacy with reduced cytotoxicity

in Medicinal and Pharmaceutical Chemistry

Jingkai Wang
Fanli Zeng
Xiaoling Chen
Tao Wang
Lei Wang
Mei Zhou
Yangyang Jiang
Tianbao Chen
Yongfei Fang
Jinwei Zhang

Frontiers in Chemistry

doi 10.3389/fchem.2025.1579097

4,652 views

Original Research

Published on 19 May 2025

H2 production in underground coal gasification with pretreatment by non-focusing microwave

in Green and Sustainable Chemistry

Lele Feng
Jie Dong
Haidong Li
Jiaxuan Sun

Frontiers in Chemistry

doi 10.3389/fchem.2025.1586267

1,712 views
3 citations

Original Research

Published on 19 May 2025

GlycoIP: an integrated platform for simultaneous and site-specific N/O-glycosylation analysis of human semen

in Analytical Chemistry

Gaoshu Yan
Fei Cai
Keliang Wu
Qingyuan Cheng
Yong Zhang
Lin Fan

Frontiers in Chemistry

doi 10.3389/fchem.2025.1569561

2,457 views
3 citations

Original Research

Published on 19 May 2025

Pore-scale numerical simulation of in situ microemulsion formation and enhanced oil recovery in porous media

in Green and Sustainable Chemistry

Yingxue Hu
Kai Dong
Dan Zhang
Tianjiang Wu
Wei Xu
Zhaolin Gu

Frontiers in Chemistry

doi 10.3389/fchem.2025.1601086

1,961 views
1 citation

Original Research

Published on 15 May 2025

Computational modeling and thermal analysis of magnetized nanofluid flow with physio-chemical interaction and chemical reaction between two non-parallel walls

in Solid State Chemistry

Shahid Sohail
Zahir Shah
Muhammad Rooman
Waris Khan
Mansoor H. Alshehri
Narcisa Vrinceanu
Elisabeta Antonescu

Frontiers in Chemistry

doi 10.3389/fchem.2025.1466356

2,727 views
2 citations

Review

Published on 14 May 2025

Advances in photocatalytic research on decarboxylative trifluoromethylation of trifluoroacetic acid and derivatives

in Photocatalysis and Photochemistry

Fang-Fang Tan
Zhan-Chao Li

Frontiers in Chemistry

doi 10.3389/fchem.2025.1602003

7,088 views
2 citations

Original Research

Published on 13 May 2025

Chronic alcohol intake disrupts cytochrome P450 enzyme activity in alcoholic fatty liver disease: insights into metabolic alterations and therapeutic targets

in Medicinal and Pharmaceutical Chemistry

Qian Zhu
Xuefeng Xie
Ling Fang
Cheng Huang
Jun Li

Frontiers in Chemistry

doi 10.3389/fchem.2025.1509785

6,201 views
5 citations

Original Research

Published on 12 May 2025

Identification of novel potential hypoxia-inducible factor-1α inhibitors through machine learning and computational simulations

in Medicinal and Pharmaceutical Chemistry

Yuxiang He
Shuning Diao
Shengzhen Hou
Taiying Li
Wenhui Meng
Jinping Zhang

Frontiers in Chemistry

doi 10.3389/fchem.2025.1585882

3,351 views
3 citations

Original Research

Published on 12 May 2025

Development of nifedipine isosteres: an integrated approach to the design, synthesis, and biological assessment of calcium channel blockers

in Medicinal and Pharmaceutical Chemistry

Yasser M. Zohny
Samir M. Awad
Omar Alsaidan
Maha A. Rabie

Frontiers in Chemistry

doi 10.3389/fchem.2025.1581037

3,234 views

Mini Review

Published on 09 May 2025

Recent advances of interfacial modification over tantalum nitride photoanodes for solar water oxidation: a mini review

in Green and Sustainable Chemistry

Pengpeng Wang
Aman Maung Than Oo
Liangji Chen
Doudou Zhang

Frontiers in Chemistry

doi 10.3389/fchem.2025.1600959

2,438 views
2 citations

Original Research

Published on 08 May 2025

Sustainable innovative nanofibers containing Cobalt-MOF: a dual-action solution for microbial and chemical wastewater contamination

in Polymer Chemistry

Safar M. Alqahtani
Dharmesh Sur
Ali Altharawi
R. Roopashree
Ahmed Hussein Zwamel
Taibah Aldakhil

Frontiers in Chemistry

doi 10.3389/fchem.2025.1584064

2,402 views
1 citation

Original Research

Published on 08 May 2025

Engineering high-performance CTAB-functionalized magnesium silicate nano-adsorbent for efficient removal of Cd2+, Co2+, and Cu2+ from single-metal aqueous solutions

in Chemical Physics and Physical Chemistry

Marwa H. Shemy
Reham A. Mohamed
Ahmed A. Abdel-Khalek
Haifa A. Alqhtani
Wail Al Zoubi
Mostafa R. Abukhadra

Frontiers in Chemistry

doi 10.3389/fchem.2025.1583305

7,810 views
6 citations

Original Research

Published on 08 May 2025

Mechanism of hedysari radix praeparata cum melle and curcumae rhizoma herb pair in colitis-associated colorectal cancer through the MAPK/NF-κB signaling pathway: an investigation in vivo and in vitro

in Medicinal and Pharmaceutical Chemistry

Ting Liu
Yugui Zhang
Feiyun Gao
Zhuanhong Zhang
Maomao Wang
Cui Ma
Yanjun Wang
Dingcai Ma
Zhe Wang
Xingke Yan

Frontiers in Chemistry

doi 10.3389/fchem.2025.1551722

4,251 views
1 citation

Original Research

Published on 08 May 2025

Discovery of a novel binding pocket in PPARγ for partial agonists: structure-based virtual screening identifies ginsenoside Rg5 as a partial agonist promoting beige adipogenesis

in Medicinal and Pharmaceutical Chemistry

Zhen Wang
Kexin Shui
Zehui Zhang
Yihan Chen
Nanfei Yang
Shiliang Ji
Pingping Shen
Qiang Tian

Frontiers in Chemistry

doi 10.3389/fchem.2025.1579445

4,653 views
2 citations

Original Research

Published on 06 May 2025

Design, synthesis, and biological investigation of new thiazole-based derivatives as multi-targeted inhibitors endowed with antiproliferative, antioxidant, and antibacterial properties

in Medicinal and Pharmaceutical Chemistry

Hesham A. M. Gomaa
Asmaa M. Atta
Mohamed E. Shaker
Sami I. Alzarea
Tariq G. Alsahli
Eid Alatwi
Arafa Musa
Fatma A. M. Mohamed
Hayat Ali Alzahrani
Aliaa M. Mohassab

Frontiers in Chemistry

doi 10.3389/fchem.2025.1595997

10,198 views
5 citations

Original Research

Published on 06 May 2025

Two-dimensional coronene fractals: modified reverse degree indices, comparative analysis of information entropy and predictive modeling of spectral properties

in Theoretical and Computational Chemistry

A. R. Abul Kalaam
A. Berin Greeni

Frontiers in Chemistry

doi 10.3389/fchem.2025.1588942

1,502 views
1 citation

Original Research

Published on 02 May 2025

Mathematical modeling and estimation of physicochemical characteristics of pneumonia treatment drugs through a novel approach K-Banhatti topological descriptors

in Theoretical and Computational Chemistry

Abdul Rauf Khan
Ifra Naeem
Fairouz Tchier
Fikadu Tesgera Tolasa
Shahid Hussain

Frontiers in Chemistry

doi 10.3389/fchem.2025.1564809

1,849 views

Original Research

Published on 02 May 2025

Sustainable dyeing of cotton, silk and leather using natural dye from Bixa orellana seeds: extraction, optimization and assessment of antibacterial activity

in Green and Sustainable Chemistry

Moorthy Muruganandham
Yuvaraj Tamilselvi
Kanagasabapathy Sivasubramanian
Palanivel Velmurugan
Fatimah Oleyan Al-Otibi
Subpiramaniyam Sivakumar

Frontiers in Chemistry

doi 10.3389/fchem.2025.1474160

4,611 views
4 citations

Brief Research Report

Published on 02 May 2025

Validation of freeze-drier/plasma asher method for analysis of asbestos in the lung tissue

in Analytical Chemistry

Anna Benedetta Somigliana

Frontiers in Chemistry

doi 10.3389/fchem.2025.1581910

1,683 views
3 citations

8,132 articles

articles

Design of novel pyrazole and benzofuran-based derivatives as potent acetylcholinesterase inhibitors for Alzheimer’s disease management

Inhibitory effect of Fisetin against the aggregation process of SOD1 E100K mutant: computer-based drug design as a potential therapeutic for ALS disease

Synthesis and characterization of thymol-derived phenoxy acetamide derivatives using DFT, molecular docking, and parasitological investigations

Exploring the application of the microbial pigment violacein as a sustainable probe molecule for recycled paper-based SERS substrates

Corrigendum: Viral mimicry as a design template for nucleic acid nanocarriers

Engineering of antimicrobial peptide Brevinin-1pl: arginine, lysine, and histidine substitutions enhance antimicrobial-anticancer efficacy with reduced cytotoxicity

H2 production in underground coal gasification with pretreatment by non-focusing microwave

GlycoIP: an integrated platform for simultaneous and site-specific N/O-glycosylation analysis of human semen

Pore-scale numerical simulation of in situ microemulsion formation and enhanced oil recovery in porous media

Computational modeling and thermal analysis of magnetized nanofluid flow with physio-chemical interaction and chemical reaction between two non-parallel walls

Advances in photocatalytic research on decarboxylative trifluoromethylation of trifluoroacetic acid and derivatives

Chronic alcohol intake disrupts cytochrome P450 enzyme activity in alcoholic fatty liver disease: insights into metabolic alterations and therapeutic targets

Identification of novel potential hypoxia-inducible factor-1α inhibitors through machine learning and computational simulations

Development of nifedipine isosteres: an integrated approach to the design, synthesis, and biological assessment of calcium channel blockers

Recent advances of interfacial modification over tantalum nitride photoanodes for solar water oxidation: a mini review

Sustainable innovative nanofibers containing Cobalt-MOF: a dual-action solution for microbial and chemical wastewater contamination

Engineering high-performance CTAB-functionalized magnesium silicate nano-adsorbent for efficient removal of Cd2+, Co2+, and Cu2+ from single-metal aqueous solutions

Mechanism of hedysari radix praeparata cum melle and curcumae rhizoma herb pair in colitis-associated colorectal cancer through the MAPK/NF-κB signaling pathway: an investigation in vivo and in vitro

Discovery of a novel binding pocket in PPARγ for partial agonists: structure-based virtual screening identifies ginsenoside Rg5 as a partial agonist promoting beige adipogenesis

Design, synthesis, and biological investigation of new thiazole-based derivatives as multi-targeted inhibitors endowed with antiproliferative, antioxidant, and antibacterial properties

Two-dimensional coronene fractals: modified reverse degree indices, comparative analysis of information entropy and predictive modeling of spectral properties

Mathematical modeling and estimation of physicochemical characteristics of pneumonia treatment drugs through a novel approach K-Banhatti topological descriptors

Sustainable dyeing of cotton, silk and leather using natural dye from Bixa orellana seeds: extraction, optimization and assessment of antibacterial activity

Validation of freeze-drier/plasma asher method for analysis of asbestos in the lung tissue