Characterizing protein-protein interactions with thermal proteome profiling

BC Searle - Current Opinion in Structural Biology, 2024 - Elsevier
Thermal proteome profiling (TPP) is an innovative technique that uses the principle of
protein thermal stability to identify potential protein interaction partners. Employing …

AI-driven antibody design with generative diffusion models: current insights and future directions

X He, J Li, J Xu, H Shan, S Shen, S Gao… - Acta Pharmacologica …, 2024 - nature.com
Therapeutic antibodies are at the forefront of biotherapeutics, valued for their high target
specificity and binding affinity. Despite their potential, optimizing antibodies for superior …

[HTML][HTML] Integrating computational design and experimental approaches for next-generation biologics

A Son, J Park, W Kim, W Lee, Y Yoon, J Ji… - Biomolecules, 2024 - pmc.ncbi.nlm.nih.gov
Therapeutic protein engineering has revolutionized medicine by enabling the development
of highly specific and potent treatments for a wide range of diseases. This review examines …

Introduction: Molecular Crowding

A Pastore, G Rivas Caballero, PA Temussi - Chemical Reviews, 2024 - ACS Publications
6697 https://doi. org/10.1021/acs. chemrev. 4c00287 Chem. Rev. 2024, 124, 6697− 6699
processes in high-viscosity environments, and several methods based on molecular …

[HTML][HTML] Diffusion of proteins in crowded solutions studied by docking-based modeling

A Singh, PJ Kundrotas, IA Vakser - The Journal of Chemical Physics, 2024 - pubs.aip.org
The diffusion of proteins is significantly affected by macromolecular crowding. Molecular
simulations accounting for protein interactions at atomic resolution are useful for …

Pair-EGRET: enhancing the prediction of protein–protein interaction sites through graph attention networks and protein language models

R Alam, S Mahbub, MS Bayzid - Bioinformatics, 2024 - academic.oup.com
Motivation Proteins are responsible for most biological functions, many of which require the
interaction of more than one protein molecule. However, accurately predicting protein …

In Silico View of Crowding: Biomolecular Processes to Nanomaterial Design

S Rajput, S Panigrahy, D Nayar - ACS omega, 2024 - ACS Publications
It is widely accepted that deciphering biomolecular structure and function requires going
beyond the single-molecule or single-complex paradigm. The densely packed …

Recent progress in modeling and simulation of biomolecular crowding and condensation inside cells

A Mathur, R Ghosh, A Nunes-Alves - Journal of Chemical …, 2024 - ACS Publications
Macromolecular crowding in the cellular cytoplasm can potentially impact diffusion rates of
proteins, their intrinsic structural stability, binding of proteins to their corresponding partners …

Transmembrane proteins in grape immunity: current knowledge and methodological advances

A Gallucci, D Giordano, A Facchiano… - Frontiers in Plant …, 2024 - frontiersin.org
Transmembrane proteins (TMPs) are pivotal components of plant defence mechanisms,
serving as essential mediators in the response to biotic stresses. These proteins are among …

Pouring SIRAH on NAMD

J Cantero, A Ballesteros-Casallas… - The Journal of …, 2024 - ACS Publications
Molecular dynamics (MD) simulations provide an invaluable platform for exploring the
dynamics of complex biomolecular systems at atomic resolution. However, compatibility …