Bioinformatics approaches to discovering food-derived bioactive peptides: Reviews and perspectives

Z Du, J Comer, Y Li - TrAC Trends in Analytical Chemistry, 2023 - Elsevier
Food-derived bioactive peptides (FBPs) are gaining interest due to their great potential in
agricultural byproduct valorization and high-activity peptide screening. The introduction of …

Molecular simulation for food protein–ligand interactions: A comprehensive review on principles, current applications, and emerging trends

Z Jin, Z Wei - Comprehensive Reviews in Food Science and …, 2024 - Wiley Online Library
In recent years, investigations on molecular interaction mechanisms between food proteins
and ligands have attracted much interest. The interaction mechanisms can supply much …

Review and perspective on bioactive peptides: A roadmap for research, development, and future opportunities

Z Du, Y Li - Journal of Agriculture and Food Research, 2022 - Elsevier
Bioactive peptides (BPs) possess a broad spectrum of beneficial effects, such as antioxidant,
antihypertensive, antidiabetic, anticancer, anti-inflammatory, antimicrobial, and anti-aging …

Application of molecular simulation methods in food science: status and prospects

Y Yu, S Xu, R He, G Liang - Journal of Agricultural and Food …, 2023 - ACS Publications
Molecular simulation methods, such as molecular docking, molecular dynamic (MD)
simulation, and quantum chemical (QC) calculation, have become popular as …

Advancements in small molecule drug design: A structural perspective

K Wu, E Karapetyan, J Schloss, J Vadgama, Y Wu - Drug Discovery Today, 2023 - Elsevier
In this review, we outline recent advancements in small molecule drug design from a
structural perspective. We compare protein structure prediction methods and explore the …

Metabolomics: A promising technique for uncovering quality-attribute of fresh and processed fruits and vegetables

K Wang, X Liao, J Xia, C Xiao, J Deng, Z Xu - Trends in Food Science & …, 2023 - Elsevier
Background Fresh and processed fruits and vegetables (F&V) contain small molecules,
which contribute to the nutritional, taste, aroma, color, and safety quality of fresh and …

Data-driven elucidation of flavor chemistry

X Kou, P Shi, C Gao, P Ma, H Xing, Q Ke… - Journal of Agricultural …, 2023 - ACS Publications
Flavor molecules are commonly used in the food industry to enhance product quality and
consumer experiences but are associated with potential human health risks, highlighting the …

High-throughput analysis of hazards in novel food based on the density functional theory and multimodal deep learning

L Shi, W Jia, R Zhang, Z Fan, W Bian, H Mo - Food Chemistry, 2024 - Elsevier
The emergence of cultured meat presents the potential for personalized food additive
manufacturing, offering a solution to address future food resource scarcity. Processing raw …

Effect of polysaccharides on conformational changes and functional properties of protein-polyphenol binary complexes: A comparative study

Z Zhang, T Li, Y Zhang, J Shao, C Ye, H Wang… - International Journal of …, 2023 - Elsevier
This study aimed to investigate the effect of different polysaccharides on the binding
behavior and functional properties of soybean protein isolate (SPI)-quercetin (Que) complex …

Deep learning drives efficient discovery of novel antihypertensive peptides from soybean protein isolate

Y Zhang, Z Dai, X Zhao, C Chen, S Li, Y Meng… - Food Chemistry, 2023 - Elsevier
As a potential and effective substitute for the drugs of antihypertension, the food-derived
antihypertensive peptides have arisen great interest in scholars recently. However, the …