Protein design with guided discrete diffusion

N Gruver, S Stanton, N Frey… - Advances in neural …, 2024 - proceedings.neurips.cc
A popular approach to protein design is to combine a generative model with a discriminative
model for conditional sampling. The generative model samples plausible sequences while …

<? sty\usepackage {wasysym}?> Bilingual language model for protein sequence and structure

M Heinzinger, K Weissenow… - NAR Genomics and …, 2024 - academic.oup.com
Adapting language models to protein sequences spawned the development of powerful
protein language models (pLMs). Concurrently, AlphaFold2 broke through in protein …

[HTML][HTML] Deep generative models for detector signature simulation: A taxonomic review

B Hashemi, C Krause - Reviews in Physics, 2024 - Elsevier
In modern collider experiments, the quest to explore fundamental interactions between
elementary particles has reached unparalleled levels of precision. Signatures from particle …

Deep Generative Models for Detector Signature Simulation: A Taxonomic Review

B Hashemi, C Krause - arxiv preprint arxiv:2312.09597, 2023 - arxiv.org
In modern collider experiments, the quest to explore fundamental interactions between
elementary particles has reached unparalleled levels of precision. Signatures from particle …

Improving protein optimization with smoothed fitness landscapes

A Kirjner, J Yim, R Samusevich, S Bracha… - The Twelfth …, 2023 - openreview.net
The ability to engineer novel proteins with higher fitness for a desired property would be
revolutionary for biotechnology and medicine. Modeling the combinatorially large space of …

LLMs are highly-constrained biophysical sequence optimizers

A Chen, SD Stanton, RG Alberstein, AM Watkins… - arxiv preprint arxiv …, 2024 - arxiv.org
Large language models (LLMs) have recently shown significant potential in various
biological tasks such as protein engineering and molecule design. These tasks typically …

Optimizing protein fitness using Gibbs sampling with Graph-based Smoothing

A Kirjner, J Yim, R Samusevich… - ICML 2023 Workshop …, 2023 - openreview.net
The ability to design novel proteins with higher fitness on a given task would be
revolutionary for many fields of medicine. However, brute-force search through the …

Advances of Deep Learning in Protein Science: A Comprehensive Survey

B Hu, C Tan, L Wu, J Zheng, J **a, Z Gao, Z Liu… - arxiv preprint arxiv …, 2024 - arxiv.org
Protein representation learning plays a crucial role in understanding the structure and
function of proteins, which are essential biomolecules involved in various biological …

Multi-Attribute Constraint Satisfaction via Language Model Rewriting

A Baheti, D Chakraborty, F Brahman, RL Bras… - arxiv preprint arxiv …, 2024 - arxiv.org
Obeying precise constraints on top of multiple external attributes is a common computational
problem underlying seemingly different domains, from controlled text generation to protein …

Deep Generative Models for Ultra-High Granularity Particle Physics Detector Simulation: A Voyage From Emulation to Extrapolation

B Hashemi - arxiv preprint arxiv:2403.13825, 2024 - arxiv.org
Simulating ultra-high-granularity detector responses in Particle Physics represents a critical
yet computationally demanding task. This thesis aims to overcome this challenge for the …