Statistical mechanics of deep linear neural networks: The backpropagating kernel renormalization

Q Li, H Sompolinsky - Physical Review X, 2021 - APS
The groundbreaking success of deep learning in many real-world tasks has triggered an
intense effort to theoretically understand the power and limitations of deep learning in the …

Vulnerabilities of connectionist AI applications: evaluation and defense

C Berghoff, M Neu, A von Twickel - Frontiers in big Data, 2020 - frontiersin.org
This article deals with the IT security of connectionist artificial intelligence (AI) applications,
focusing on threats to integrity, one of the three IT security goals. Such threats are for …

Parallel tempered genetic algorithm guided by deep neural networks for inverse molecular design

AK Nigam, R Pollice, A Aspuru-Guzik - Digital Discovery, 2022 - pubs.rsc.org
Inverse molecular design involves algorithms that sample molecules with specific target
properties from a multitude of candidates and can be posed as an optimization problem …

Graph-based molecular Pareto optimisation

J Verhellen - Chemical Science, 2022 - pubs.rsc.org
Computer-assisted design of small molecules has experienced a resurgence in academic
and industrial interest due to the widespread use of data-driven techniques such as deep …

Quantum field-theoretic machine learning

D Bachtis, G Aarts, B Lucini - Physical Review D, 2021 - APS
We derive machine learning algorithms from discretized Euclidean field theories, making
inference and learning possible within dynamics described by quantum field theory …

Text‐to‐3D Shape Generation

H Lee, M Savva, AX Chang - Computer Graphics Forum, 2024 - Wiley Online Library
Recent years have seen an explosion of work and interest in text‐to‐3D shape generation.
Much of the progress is driven by advances in 3D representations, large‐scale pretraining …

Predictive Power of a Bayesian Effective Action for Fully Connected One Hidden Layer Neural Networks in the Proportional Limit

P Baglioni, R Pacelli, R Aiudi, F Di Renzo, A Vezzani… - Physical Review Letters, 2024 - APS
We perform accurate numerical experiments with fully connected one hidden layer neural
networks trained with a discretized Langevin dynamics on the MNIST and CIFAR10 …

Parameter estimation for the cosmic microwave background with Bayesian neural networks

HJ Hortúa, R Volpi, D Marinelli, L Malagò - Physical Review D, 2020 - APS
In this paper, we present the first study that compares different models of Bayesian neural
networks (BNNs) to predict the posterior distribution of the cosmological parameters directly …

[HTML][HTML] Curvature-enhanced graph convolutional network for biomolecular interaction prediction

C Shen, P Ding, J Wee, J Bi, J Luo, K Xia - Computational and Structural …, 2024 - Elsevier
Geometric deep learning has demonstrated a great potential in non-Euclidean data
analysis. The incorporation of geometric insights into learning architecture is vital to its …

Q‐EANet: Implicit social modeling for trajectory prediction via experience‐anchored queries

J Chen, Z Wang, J Wang, B Cai - IET Intelligent Transport …, 2024 - Wiley Online Library
Accurately predicting the future trajectory and behavior of traffic participants is crucial for the
maneuvers of self‐driving vehicles. Many existing works employed a learning‐based …