Structure-based protein design with deep learning

S Ovchinnikov, PS Huang - Current opinion in chemical biology, 2021 - Elsevier
Since the first revelation of proteins functioning as macromolecular machines through their
three dimensional structures, researchers have been intrigued by the marvelous ways the …

[HTML][HTML] Deep generative modeling for protein design

A Strokach, PM Kim - Current opinion in structural biology, 2022 - Elsevier
Deep learning approaches have produced substantial breakthroughs in fields such as
image classification and natural language processing and are making rapid inroads in the …

Large language models generate functional protein sequences across diverse families

A Madani, B Krause, ER Greene, S Subramanian… - Nature …, 2023 - nature.com
Deep-learning language models have shown promise in various biotechnological
applications, including protein design and engineering. Here we describe ProGen, a …

Generalized biomolecular modeling and design with RoseTTAFold All-Atom

R Krishna, J Wang, W Ahern, P Sturmfels, P Venkatesh… - Science, 2024 - science.org
Deep-learning methods have revolutionized protein structure prediction and design but are
presently limited to protein-only systems. We describe RoseTTAFold All-Atom (RFAA), which …

MSA transformer

RM Rao, J Liu, R Verkuil, J Meier… - International …, 2021 - proceedings.mlr.press
Unsupervised protein language models trained across millions of diverse sequences learn
structure and function of proteins. Protein language models studied to date have been …

Protein language-model embeddings for fast, accurate, and alignment-free protein structure prediction

K Weissenow, M Heinzinger, B Rost - Structure, 2022 - cell.com
Advanced protein structure prediction requires evolutionary information from multiple
sequence alignments (MSAs) from evolutionary couplings that are not always available …

Light attention predicts protein location from the language of life

H Stärk, C Dallago, M Heinzinger… - Bioinformatics …, 2021 - academic.oup.com
Although knowing where a protein functions in a cell is important to characterize biological
processes, this information remains unavailable for most known proteins. Machine learning …

A perspective on the prospective use of AI in protein structure prediction

R Versini, S Sritharan, B Aykac Fas… - Journal of Chemical …, 2023 - ACS Publications
AlphaFold2 (AF2) and RoseTTaFold (RF) have revolutionized structural biology, serving as
highly reliable and effective methods for predicting protein structures. This article explores …

Protein design with deep learning

M Defresne, S Barbe, T Schiex - International Journal of Molecular …, 2021 - mdpi.com
Computational Protein Design (CPD) has produced impressive results for engineering new
proteins, resulting in a wide variety of applications. In the past few years, various efforts have …

Protein language models and structure prediction: Connection and progression

B Hu, J **a, J Zheng, C Tan, Y Huang, Y Xu… - arxiv preprint arxiv …, 2022 - arxiv.org
The prediction of protein structures from sequences is an important task for function
prediction, drug design, and related biological processes understanding. Recent advances …