78 citations · 253 across the 56 of their papers we have counts for
7 papers · 1 filter
Kinetic Langevin Diffusion for Crystalline Materials Generation
François Cornet, Federico Bergamin, Arghya Bhowmik +3
Generative modeling of crystalline materials using diffusion models presents a series of challenges: the data distribution is characterized by inherent symmetries and involves mult…
Exploring bidirectional bounds for minimax-training of Energy-based models
Cong Geng, Jia Wang, Li Chen +3
Energy-based models (EBMs) estimate unnormalized densities in an elegant framework, but they are generally difficult to train. Recent work has linked EBMs to generative adversarial…
Zero-shot protein stability prediction by inverse folding models: a free energy interpretation
Jes Frellsen, Maher M. Kassem, Tone Bengtsen +4
Inverse folding models have proven to be highly effective zero-shot predictors of protein stability. Despite this success, the link between the amino acid preferences of an inverse…
Hyper-Transforming Latent Diffusion Models
Ignacio Peis, Batuhan Koyuncu, Isabel Valera +1
We introduce a novel generative framework for functions by integrating Implicit Neural Representations (INRs) and Transformer-based hypernetworks into latent variable models. Unlik…
Learning Energy-Based Models by Self-normalising the Likelihood
Hugo Senetaire, Paul Jeha, Pierre-Alexandre Mattei +1
Training an energy-based model (EBM) with maximum likelihood is challenging due to the intractable normalisation constant. Traditional methods rely on expensive Markov chain Monte…
Debiasing Guidance for Discrete Diffusion with Sequential Monte Carlo
Cheuk Kit Lee, Paul Jeha, Jes Frellsen +3
Discrete diffusion models are a class of generative models that produce samples from an approximated data distribution within a discrete state space. Often, there is a need to targ…
The magnetic scalar potential for a rectangular prism
Berian James, Stefan Pollok, Jes Frellsen +1
We analytically solve Poisson's equation for the magnetic scalar potential generated by a uniformly magnetized rectangular prism and determine a closed-form solution for the magnet…