Insights into in-vitro studies and molecular modelling of the antimicrobial efficiency of 4-chlorobenzaldehyde and 4-methoxybenzaldehyde derivatives

MAF Mohamed, I Benjamin, GA Okon… - Journal of …, 2024 - Taylor & Francis
Owing to the significant gap in the knowledge and understanding of the mechanisms of
antimicrobial action and the development of resistance, the optimization of antimicrobial …

Antibacterial potential of trihydroxycyclohexa-2, 4-diene-1-carboxylic acid: Insight from DFT, molecular docking, and molecular dynamic simulation

AE Owen, CM Chima, I Ahmad, W Emori… - Polycyclic Aromatic …, 2024 - Taylor & Francis
Abstract In this study,(z)-5-((3-(2, 3-dihydroxyphenyl) acryloyl) oxy)-1, 3, 4-
trihydroxycyclohexa-2, 4-diene-1-carboxylic acid (chlorogenic acid) was isolated and …

Effect of solvation on the molecular structure, vibrational assignment, nature of bonding, and the antiviral drug-like potential of troxerutin against HBV proteins

CR Cheng, UO Edet, I Benjamin, CU Okoro… - Journal of the Indian …, 2023 - Elsevier
Drugs used in the management of Hepatitis B virus (HBV) infection are largely based on
nucleosides or their analogues and these have several side-effects. These drugs only inhibit …

Investigation of the Anti-Plasmodial Properties of N-2-Oxo Pyrrolidine Pentanamide-Based Sulfonamides: Experimental and Theoretical Approach

FC Asogwa, O C. Ekoh, D I. Ugwu… - Polycyclic Aromatic …, 2024 - Taylor & Francis
The study aimed to investigate novel pyrrolidine-pentanamide derivatives of sulfonamides
as potential anti-malaria agents through a comprehensive approach involving experimental …

Inflammatory studies of dehydroandrographolide: isolation, spectroscopy, biological activity, and theoretical modeling

L Ling, H Louis, BB Isang, W Emori, I Benjamin… - Applied Biochemistry …, 2024 - Springer
Dehydroandrographolide (DA) was isolated and experimentally characterized utilizing FT-
IR, UV-Vis, and NMR spectroscopy techniques along with detailed theoretical modelled at …

Natural Andrographolide Isolated from Andrographis paniculata as Potent Epileptic Agent: Spectroscopy, Molecular Structure, and Molecular Docking Investigation

AE Owen, H Louis, EU Ejiofor, W Emori, TE Gber… - Chemistry Africa, 2023 - Springer
In this study, a comparative experimental and theoretical investigation of the isolation,
characterization, and molecular electronic investigation of natural andrographolide is …

[HTML][HTML] Anti-hypertensive properties of 2-[N-(4-methylbenzenesulfonyl)-1-phenylformamido]-n-(4-nitrophenyl)-3-phenylpropenamide: experimental and theoretical …

DI Ugwu, FC Asogwa, SG Olisaeloka, JA Ezugwu… - Chemical Physics …, 2023 - Elsevier
Experimental and theoretical investigation of the anti-hypertensive activity of novel 2-[N-(4-
methylbenzenesulfonyl)-1-phenylformamido]-N-(4-nitrophenyl)-3-phenylpropenamide …

Microwave-assisted click synthesis, characterisation, and In silico studies of novel 2H-chromene-1, 2, 3-triazolyl glycoconjugates as potent anticancer and …

BS Panda, MA Ahemad, S Mohapatra, E Naik… - Journal of Molecular …, 2024 - Elsevier
A series of novel 2H-chromene-1, 2, 3-triazolyl glycoconjugates 10a-w were synthesized,
well characterized and evaluated for their in vitro antimicrobial and anticancer activities …

Exploring the anticancer potential of sulfate-hydroxy-butanone derivatives: insights from experimental and quantum chemical investigations

AE Owen, EI Ime, EN Mbim, HO Edet… - Zeitschrift für …, 2023 - degruyter.com
Urinary incontinence and erectile dysfunction represent enduring adverse outcomes
resulting from prostate cancer, a leading cause of global mortality. Given this critical context …

Exploring the Potential of Compounds Isolated from Laranthus micranthus for the Treatment of Benign Prostatic Hyperplasia: Comprehensive Studies on …

RU Ukpanukpong, AE Azubuike, EI Agwupuye… - Chemistry Africa, 2024 - Springer
Owing to the significant challenges encountered in the diagnosis, management, and
treatment of benign prostatic hyperplasia (BPH), which have emerged as essential clinical …