In vitro anti-inflammatory properties of honey flavonoids: A review

B Silva, FC Biluca, LV Gonzaga, R Fett… - Food research …, 2021 - Elsevier
Honey is a natural ready-to-eat product rich in flavonoids, which is known by the wound
healing properties due to both antibacterial and antioxidant activity. Flavonoids mitigate …

[HTML][HTML] From traditional ethnopharmacology to modern natural drug discovery: A methodology discussion and specific examples

S Pirintsos, A Panagiotopoulos, M Bariotakis… - Molecules, 2022 - mdpi.com
Ethnopharmacology, through the description of the beneficial effects of plants, has provided
an early framework for the therapeutic use of natural compounds. Natural products, either in …

[HTML][HTML] Antibacterial Potential of Bacopa monnieri (L.) Wettst. and Its Bioactive Molecules against Uropathogens—An In Silico Study to Identify Potential Lead …

J Mehta, K Utkarsh, S Fuloria, T Singh, M Sekar… - Molecules, 2022 - mdpi.com
Urinary tract infections (UTIs) are becoming more common, requiring extensive protection
from antimicrobials. The global expansion of multi-drug resistance uropathogens in the past …

Planet: a multi-objective graph neural network model for protein–ligand binding affinity prediction

X Zhang, H Gao, H Wang, Z Chen… - Journal of Chemical …, 2023 - ACS Publications
Predicting protein–ligand binding affinity is a central issue in drug design. Various deep
learning models have been published in recent years, where many of them rely on 3D …

Molecular docking: principles, advances, and its applications in drug discovery

MT Muhammed, E Aki-Yalcin - Letters in Drug Design & …, 2024 - ingentaconnect.com
Molecular docking is a structure-based computational method that generates the binding
pose and affinity between ligands and targets. There are many powerful docking programs …

An integrated approach using ozone nanobubble and cyclodextrin inclusion complexation to enhance the removal of micropollutants

W Fan, W An, M Huo, D Xiao, T Lyu, J Cui - Water Research, 2021 - Elsevier
Ozone (O 3) has been widely used for the elimination of recalcitrant micropollutants in
aqueous environments, due to its strong oxidation ability. However, the utilization efficiency …

[HTML][HTML] Molecular docking in organic, inorganic, and hybrid systems: A tutorial review

M Mohanty, PS Mohanty - Monatshefte für Chemie-Chemical Monthly, 2023 - Springer
Molecular docking simulation is a very popular and well-established computational
approach and has been extensively used to understand molecular interactions between a …

Evaluating protein binding interfaces with transformer networks

V Stebliankin, A Shirali, P Baral, J Shi… - Nature Machine …, 2023 - nature.com
Computational protein-binding studies are widely used to investigate fundamental biological
processes and facilitate the development of modern drugs, vaccines and therapeutics …

Role of medicinal plants from North Western Himalayas as an efflux pump inhibitor against MDR AcrAB-TolC Salmonella enterica serovar typhimurium: In vitro and In …

J Mehta, R Rolta, K Dev - Journal of Ethnopharmacology, 2022 - Elsevier
Abstract Ethnopharmacological relevance Zingiber officinale Roscoe has been utilized
traditionally to cure various diseases like cold, cough, diarrhoea, nausea, asthma, vomiting …

Opportunities and challenges in managing antibiotic resistance in bacteria using plant secondary metabolites

B Kongkham, D Prabakaran, H Puttaswamy - Fitoterapia, 2020 - Elsevier
Abstract Development of antibiotic resistance (ABR) in bacteria and its multidimensional
spread is an emerging global threat that needs immediate attention. Extensive antibiotics …