Original Research

Accepted on 12 Nov 2024

Screening, Optimization, and ADMET Evaluation of HCJ007 for Pancreatic Cancer Treatment Through Active Learning and Dynamics Simulation

in Theoretical and Computational Chemistry

Yunyun Xu
Qiang Wang
GaoQiang Xu
YouJian Xu
yiping mou

Frontiers in Chemistry

doi 10.3389/fchem.2024.1482758

Original Research

Published on 12 Nov 2024

The combined signatures of programmed cell death and immune landscape provide a prognostic and therapeutic biomarker in the hepatocellular carcinoma

in Supramolecular Chemistry

Wanghu Liu
Yan Huang
Yang Xu
Xuanji Gao
Yifan Zhao
Simin Fan
Yuanzhi Geng
Shajun Zhu

Frontiers in Chemistry

doi 10.3389/fchem.2024.1484310

187 views

Original Research

Published on 12 Nov 2024

Chromatographic analysis of ponatinib and its impurities: method development, validation, and identification of new degradation product

in Analytical Chemistry

Jing Wang
Yonghong Zhu
Jisu Qin
Wenyi Wu
Rongrong Huang
Liangliang Cai

Frontiers in Chemistry

doi 10.3389/fchem.2024.1487108

284 views

Original Research

Published on 12 Nov 2024

Synthesis, enzyme inhibition, and docking studies of new schiff bases of disalicylic acid methylene-based derivatives as dual-target antibacterial agents

in Medicinal and Pharmaceutical Chemistry

Lamya H. Al-Wahaibi
Mohamed A. Mahmoud
Hayat Ali Alzahrani
Hesham A. Abou-Zied
Alshaimaa Abdelmoez
Bahaa G. M. Youssif
Stefan Bräse
Safwat M. Rabea

Frontiers in Chemistry

doi 10.3389/fchem.2024.1493906

301 views

Original Research

Accepted on 11 Nov 2024

A Comparative Study of Topological Entropy Characterization and Graph Energy Prediction for Marta Variants of Covalent Organic Frameworks

in Theoretical and Computational Chemistry

Zahid Raza
Micheal Arockiaraj
Aravindan Maaran
Arul Jeya Shalini

Frontiers in Chemistry

doi 10.3389/fchem.2024.1511678

Original Research

Accepted on 11 Nov 2024

Composition and antimicrobial activity of hydroalcoholic extracts of Pleurotus eryngii var. ferulae and P. eryngii var. elaeoselini

in Medicinal and Pharmaceutical Chemistry

Flavio Polito
Laura De Martino
Giulia Mirabile
Giuseppe Venturella
Maria Letizia Gargano
Vincenzo De Feo
Hazem Elshafie
Ippolito Camele

Frontiers in Chemistry

doi 10.3389/fchem.2024.1498787

Original Research

Accepted on 11 Nov 2024

Viability and Functional Impact of Probiotic and Starter Cultures in Salami-Type Fermented Meat Products

in Chemical Biology

Emma Mani-López
Ricardo H Hernández-Figueroa
Aurelio López-Malo
Jocksan I. Morales-Camacho

Frontiers in Chemistry

doi 10.3389/fchem.2024.1507370

Original Research

Accepted on 11 Nov 2024

Electronic Structure of Metal Oxide Dications with Ammonia Ligands and Their Reactivity Towards the Selective Conversion of Methane to Methanol

in Theoretical and Computational Chemistry

Emily Claveau
Evangelos Miliordos

Frontiers in Chemistry

doi 10.3389/fchem.2024.1508515

Original Research

Accepted on 11 Nov 2024

Oxidative Coupling of N-Nitrosoanilines with Substituted Allyl Alcohols under Rhodium (III) Catalysis

in Organic Chemistry

Priyanka Chaudhary

Frontiers in Chemistry

doi 10.3389/fchem.2024.1506493

Original Research

Published on 11 Nov 2024

Amino-functionalized vertically ordered mesoporous silica film on electrochemically polarized screen-printed carbon electrodes for the construction of gated electrochemical aptasensors and sensitive detection of carcinoembryonic antigens

in Electrochemistry

Ke He
Hongxin Wang
Tao Luo
Fei Yan
Jing Guo

Frontiers in Chemistry

doi 10.3389/fchem.2024.1490940

209 views

Original Research

Accepted on 08 Nov 2024

Antioxidant potential, antimicrobial activity, polyphenol profile analysis, and cytotoxicity against breast cancer cell lines of hydroethanolic extracts of leaves of (Ficus carica L.) from Eastern Morocco

in Medicinal and Pharmaceutical Chemistry

Aziz Tikent
Salah LAARAJ
Toufik Bouddine
Mohamed Chebaibi
Mohamed Bouhrim
ELFAZAZI Kaoutar
Ali Alqahtani
Omar M. Noman
Lhoussain Hajji
Larbi Rhazi

Frontiers in Chemistry

doi 10.3389/fchem.2024.1505473

113 views

Review

Published on 08 Nov 2024

Micro/nanorobots for gastrointestinal tract

in Chemical Physics and Physical Chemistry

Ziqi Sui
Chugen Wan
Hefei Cheng
Bin Yang

Frontiers in Chemistry

doi 10.3389/fchem.2024.1423696

228 views

Correction

Published on 07 Nov 2024

Corrigendum: Influence of anionic species on the low temperature pyrolysis performance of heated tobacco sheets catalyzed by sodium salts

in Green and Sustainable Chemistry

Xuebin Zhao
Qiuling Wang
Dan Ai
Haiying Tian
Zhan Zhang
Ke Cao
Yixuan Wang
Wei Qi
Bo Li
Yapeng Niu

Frontiers in Chemistry

doi 10.3389/fchem.2024.1508480

108 views

Original Research

Published on 07 Nov 2024

Construction of middle-phase microemulsion system and its micro-mechanism on displacing residual oil in low-permeability porous media

in Molecular Liquids

Tianjiang Wu
Teng Wang
Yingxue Hu
Jiajun Chen
Junwei Su

Frontiers in Chemistry

doi 10.3389/fchem.2024.1465706

382 views

Original Research

Published on 07 Nov 2024

Digital identification and adulteration analysis of Codonopsis Radix and Stellariae Radix based on the “digital identity” of chemical compositions

in Analytical Chemistry

Xianrui Wang
Jiating Zhang
Wenguang Jing
Xiaohan Guo
Minghua Li
Xianlong Cheng
Feng Wei

Frontiers in Chemistry

doi 10.3389/fchem.2024.1438321

248 views

Original Research

Accepted on 06 Nov 2024

Computational Modeling of Cyclotides as Antimicrobial Agents Against Neisseria gonorrhoeae PorB Porin Protein: Integration of Docking, Immune, and Molecular Dynamics Simulations

in Theoretical and Computational Chemistry

Muzamal Hussain
Nazia Kanwal
Alishba Jahangir
Nouman Ali
Nimra Hanif
Obaid Ullah

Frontiers in Chemistry

doi 10.3389/fchem.2024.1493165

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Articles

Screening, Optimization, and ADMET Evaluation of HCJ007 for Pancreatic Cancer Treatment Through Active Learning and Dynamics Simulation

The combined signatures of programmed cell death and immune landscape provide a prognostic and therapeutic biomarker in the hepatocellular carcinoma

Chromatographic analysis of ponatinib and its impurities: method development, validation, and identification of new degradation product

Synthesis, enzyme inhibition, and docking studies of new schiff bases of disalicylic acid methylene-based derivatives as dual-target antibacterial agents

A Comparative Study of Topological Entropy Characterization and Graph Energy Prediction for Marta Variants of Covalent Organic Frameworks

Composition and antimicrobial activity of hydroalcoholic extracts of Pleurotus eryngii var. ferulae and P. eryngii var. elaeoselini

Viability and Functional Impact of Probiotic and Starter Cultures in Salami-Type Fermented Meat Products

Electronic Structure of Metal Oxide Dications with Ammonia Ligands and Their Reactivity Towards the Selective Conversion of Methane to Methanol

Oxidative Coupling of N-Nitrosoanilines with Substituted Allyl Alcohols under Rhodium (III) Catalysis

Amino-functionalized vertically ordered mesoporous silica film on electrochemically polarized screen-printed carbon electrodes for the construction of gated electrochemical aptasensors and sensitive detection of carcinoembryonic antigens

Antioxidant potential, antimicrobial activity, polyphenol profile analysis, and cytotoxicity against breast cancer cell lines of hydroethanolic extracts of leaves of (Ficus carica L.) from Eastern Morocco

Micro/nanorobots for gastrointestinal tract

Corrigendum: Influence of anionic species on the low temperature pyrolysis performance of heated tobacco sheets catalyzed by sodium salts

Construction of middle-phase microemulsion system and its micro-mechanism on displacing residual oil in low-permeability porous media

Digital identification and adulteration analysis of Codonopsis Radix and Stellariae Radix based on the “digital identity” of chemical compositions

Computational Modeling of Cyclotides as Antimicrobial Agents Against Neisseria gonorrhoeae PorB Porin Protein: Integration of Docking, Immune, and Molecular Dynamics Simulations