Vaccine development using artificial intelligence and machine learning: A review

VS Asediya, PA Anjaria, RA Mathakiya… - International Journal of …, 2024 - Elsevier
The COVID-19 pandemic has underscored the critical importance of effective vaccines, yet
their development is a challenging and demanding process. It requires identifying antigens …

Merizo: a rapid and accurate protein domain segmentation method using invariant point attention

AM Lau, SM Kandathil, DT Jones - Nature Communications, 2023 - nature.com
Abstract The AlphaFold Protein Structure Database, containing predictions for over 200
million proteins, has been met with enthusiasm over its potential in enriching structural …

Exploring structural diversity across the protein universe with the Encyclopedia of Domains

AM Lau, N Bordin, SM Kandathil, I Sillitoe, VP Waman… - Science, 2024 - science.org
The AlphaFold Protein Structure Database (AFDB) contains more than 214 million predicted
protein structures composed of domains, which are independently folding units found in …

Chainsaw: protein domain segmentation with fully convolutional neural networks

J Wells, A Hawkins-Hooker, N Bordin, I Sillitoe… - …, 2024 - academic.oup.com
Motivation Protein domains are fundamental units of protein structure and play a pivotal role
in understanding folding, function, evolution, and design. The advent of accurate structure …

Improved protein structure prediction with trRosettaX2, AlphaFold2, and optimized MSAs in CASP15

Z Peng, W Wang, H Wei, X Li… - … : Structure, Function, and …, 2023 - Wiley Online Library
We present the monomer and multimer structure prediction results of our methods in
CASP15. We first designed an elaborate pipeline that leverages complementary sequence …

CATH v4. 4: major expansion of CATH by experimental and predicted structural data

VP Waman, N Bordin, A Lau, S Kandathil… - Nucleic Acids …, 2025 - academic.oup.com
Abstract CATH (https://www. cathdb. info) is a structural classification database that assigns
domains to the structures in the Protein Data Bank (PDB) and AlphaFold Protein Structure …

A genomic analysis reveals the diversity of cellulosome displaying bacteria

CM Minor, A Takayesu, SM Ha, L Salwinski… - Frontiers in …, 2024 - frontiersin.org
Introduction Several species of cellulolytic bacteria display cellulosomes, massive multi-
cellulase containing complexes that degrade lignocellulosic plant biomass (LCB). A greater …

Deep learning for the PSIPRED Protein Analysis Workbench

DWA Buchan, L Moffat, A Lau… - Nucleic Acids …, 2024 - academic.oup.com
The PSIRED Workbench is a long established and popular bioinformatics web service
offering a wide range of machine learning based analyses for characterizing protein …

Scalable normalizing flows enable Boltzmann generators for macromolecules

JC Kim, D Bloore, K Kapoor, J Feng, MH Hao… - arxiv preprint arxiv …, 2024 - arxiv.org
The Boltzmann distribution of a protein provides a roadmap to all of its functional states.
Normalizing flows are a promising tool for modeling this distribution, but current methods are …

[HTML][HTML] CATH 2024: CATH-AlphaFlow Doubles the Number of Structures in CATH and Reveals Nearly 200 New Folds

VP Waman, N Bordin, R Alcraft, R Vickerstaff… - Journal of Molecular …, 2024 - Elsevier
Abstract CATH (https://www. cathdb. info) classifies domain structures from experimental
protein structures in the PDB and predicted structures in the AlphaFold Database (AFDB). To …