Frontiers in Chemistry

Original Research

Published on 17 Jan 2025

Computational measures of irregularity molecular descriptors of octahedral and icosahedral networks

in Theoretical and Computational Chemistry

Xiujun Zhang
Hafiz Mutee ur Rehman
M. Mobeen Munir

Frontiers in Chemistry

doi 10.3389/fchem.2024.1485184

796 views

Original Research

Published on 17 Jan 2025

In silico identification of the anticataract target of βB2-crystallin from Phaseolus vulgaris: a new insight into cataract treatment

in Medicinal and Pharmaceutical Chemistry

Sunday Amos Onikanni
Adewale Oluwaseun Fadaka
Tran Nhat Phong Dao
Valens Munyembaraga
Vincent Nyau
Nicole Remaliah Samantha Sibuyi
Morenike Grace Ajayi
Nguyen Thi Ai Nhung
Emmanuel Ejiofor
Basiru Olaitan Ajiboye

Frontiers in Chemistry

doi 10.3389/fchem.2024.1421534

1,770 views

Original Research

Published on 16 Jan 2025

Therapeutic potential of Curcuma longa against monkeypox: antioxidant, anti-inflammatory, and computational insights

in Theoretical and Computational Chemistry

Farouk Boudou
Amal Belakredar
Ahcen Keziz
Linda Aissani
Huda Alsaeedi
David Cronu
Mikhael Bechelany
Ahmed Barhoum

Frontiers in Chemistry

doi 10.3389/fchem.2024.1509913

1,933 views
2 citations

Original Research

Published on 16 Jan 2025

Exploring the potential of some natural indoles as antiviral agents: quantum chemical analysis, inverse molecular docking, and affinity calculations

in Medicinal and Pharmaceutical Chemistry

Amany Belal
Aly Abdou
Samar F. Miski
Mohamed A. M. Ali
Heba I. Ghamry
Ahmad J. Obaidullah
Mohamed Y. Zaky
Ahmed H. E. Hassan
Eun Joo Roh
Ahmed A. Al-Karmalawy

Frontiers in Chemistry

doi 10.3389/fchem.2024.1521298

2,859 views

Original Research

Published on 16 Jan 2025

Efficient photocatalytic degradation of bisphenol A on 2D-3D spherically hierarchical structure Zn5In2S8

in Photocatalysis and Photochemistry

Zongwen Zhang
Yi Zhang
Huili Han
Riyadh Ramadhan Ikreedeegh
Syed Shoaib Ahmad Shah
Muhammad Tayyab

Frontiers in Chemistry

doi 10.3389/fchem.2024.1519370

1,800 views
1 citation

Original Research

Published on 15 Jan 2025

Syzygium aromaticum extract mediated, sustainable silver nanoparticle synergetic with heterocyclic antibiotic clarithromycin and their antimicrobial activities

in Medicinal and Pharmaceutical Chemistry

Zehra Edis
Samir Haj Bloukh
Akram A. Ashames
Moawia M. Al-Tabakha
Moyad J. S. A. Shahwan
Hamed Abu Sara
Sai H. S. Boddu
Sohaib N. Khan
Ibrahim Haj Bloukh
Maram Eladdasy

Frontiers in Chemistry

doi 10.3389/fchem.2024.1513150

1,912 views
3 citations

Original Research

Published on 15 Jan 2025

Evaluation of the viability of microencapsulated Trichoderma longibrachiatum conidia as a strategy to prolong the shelf life of the fungus as a biological control agent

in Green and Sustainable Chemistry

Luis Diego Arias-Chavarría
Diego Batista-Menezes
Steffany Orozco-Cayasso
Alejandro Vargas-Martínez
José Roberto Vega-Baudrit
Gabriela Montes de Oca-Vásquez

Frontiers in Chemistry

doi 10.3389/fchem.2024.1473217

2,248 views

Original Research

Published on 15 Jan 2025

Upconverter loaded MoS2 counter electrode for broadband dye-sensitized solar cell applications

in Electrochemistry

J. Kawya
M. Durairaj
S. Anandan
T. C. Sabari Girisun

Frontiers in Chemistry

doi 10.3389/fchem.2024.1511600

1,361 views

Original Research

Published on 14 Jan 2025

Mathematical model and stability of SWCNT- and MWCNT-based nanofluid flow with thermal and chemically reactive effects inside a porous vertical cone

in Theoretical and Computational Chemistry

Haihua Xu
Fuad A. Awwad
Emad A. A. Ismail
Waris Khan

Frontiers in Chemistry

doi 10.3389/fchem.2024.1463778

906 views
1 citation

Original Research

Published on 14 Jan 2025

A computational chemistry-based approach to optimizing PD-1/PD-L1 inhibitors

in Medicinal and Pharmaceutical Chemistry

Meijuan Zhai
Shiliang Ji
Haoran Hu
Yongjie Wu
Yi Shi
Ruifang Zhu
Yiguo Jiang
Yang Yang

Frontiers in Chemistry

doi 10.3389/fchem.2024.1533541

1,265 views

Original Research

Published on 13 Jan 2025

Research on detection methods of related substances and degradation products of the antitumor drug selpercatinib

in Analytical Chemistry

Jingjing Xiang
Liangliang Cai
Qin Wang
Yonghong Zhu
Yong Han

Frontiers in Chemistry

doi 10.3389/fchem.2024.1534132

1,294 views

Original Research

Published on 13 Jan 2025

Design, synthesis, and apoptotic antiproliferative action of new benzimidazole/1,2,3-triazole hybrids as EGFR inhibitors

in Medicinal and Pharmaceutical Chemistry

Alshimaa A. Y. Ahmed
Anber F. Mohammed
Zainab M. Almarhoon
Stefan Bräse
Bahaa G. M. Youssif

Frontiers in Chemistry

doi 10.3389/fchem.2024.1541846

5,260 views

Mini Review

Published on 10 Jan 2025

Nanogenerators for gas sensing applications

in Green and Sustainable Chemistry

Ye-Xuan Zhen
Gong Wang
Yun-Fei Li
Yu Yu

Frontiers in Chemistry

doi 10.3389/fchem.2024.1532018

1,366 views

Original Research

Published on 10 Jan 2025

A genetically encoded fluorescent biosensor for sensitive detection of cellular c-di-GMP levels in Escherichia coli

in Chemical Biology

He Li
Shu Quan
Wei He

Frontiers in Chemistry

doi 10.3389/fchem.2024.1528626

2,054 views

Original Research

Published on 10 Jan 2025

Hybridized triboelectric nanogenerators for simultaneously scavenging droplet and wind energies

in Green and Sustainable Chemistry

Chaosheng Hu
Chengmin Bao
Yang Liu
Yingzhan Yan
Yanan Bai
Qian Xu

Frontiers in Chemistry

doi 10.3389/fchem.2024.1538660

1,572 views

Original Research

Published on 09 Jan 2025

Two previously undescribed triterpenoid saponins from the roots and rhizomes of Caulophyllum robustum Maxim

in Medicinal and Pharmaceutical Chemistry

Cong-Yu Zhang
Yu-Mei Wang
Peng-Cheng Qiu
Jia-Yu Feng
Bing-Wen Wang
Yu Cao
Yi-Sha Wei
Yi-Tong Zhou
Hai-Feng Tang
Yun-Yang Lu

Frontiers in Chemistry

doi 10.3389/fchem.2024.1507891

1,343 views