Energy-Based Models (EBMs) provide an interpretable framework for generative modeling of scientific data, but poor Markov Chain Monte Carlo mixing often limits their reliability. We introduce a training algorithm based on Parallel Trajectory Tempering (PTT), which exploits the continuity of the optimization path to maintain equilibrium sampling throughout learning.
arXiv:2607. 27077v1 Announce Type: new Abstract: Energy-Based Models (EBMs) provide an interpretable framework for generative modeling of scientific data, but poor Markov Chain Monte Carlo mixing often limits their reliability.
The paper introduces Langevin simulated bifurcation (LSB), a fast, parallel Boltzmann sampler that matches the accuracy of sequential MCMC methods. It also proposes conditional expectation matching (CEM), an efficient technique for estimating the effective temperature of samples from energy‑based models with conditional independence. Building on these, the authors develop sampler adaptive learning (SAL), which adjusts the model temperature to align with the distribution produced by LSB, enabling efficient training of semi‑restricted Boltzmann machines (SRBMs) and outperforming conventional methods on synthetic spin‑glass datasets.
arXiv:2602. 03729v3 Announce Type: replace Abstract: Sampling from unnormalized probability densities is a central challenge in computational science.
arXiv:2605. 31498v2 Announce Type: replace Abstract: A long standing challenge in computational chemistry and biophysics is efficiently sampling the Boltzmann distribution of molecules.
arXiv:2601. 21026v2 Announce Type: replace-cross Abstract: Sampling configurations at thermodynamic equilibrium is a central challenge in statistical physics.
arXiv:2608. 07648v1 Announce Type: cross Abstract: Sampling high-dimensional probability distributions is a central task in scientific computing, with applications ranging from Bayesian inference to statistical physics and molecular simulation.
The paper introduces a new transition kernel for Restricted Boltzmann Machines that operates over the sequence of models used in Deep Tempering. This kernel employs a round‑trip structure, allowing nonlocal moves in a single transition while keeping the RBM sequence unchanged. Experiments demonstrate that it achieves higher sampling quality with fewer transitions than both blocked Gibbs sampling and Deep Tempering, and it stabilizes learning by reducing training failures.
arXiv:2609.15439v1 Announce Type: cross Abstract: Generative thermodynamic computers turn thermal noise into structured data through Langevin dynamics. We train these systems with a local update at e...
The paper introduces IsingFormer, a Transformer model trained on long‑run MCMC configurations, which provides global proposal moves for Parallel Tempering (PT). By integrating these learned proposals into PT—forming Transformer‑Augmented Parallel Tempering (TAPT)—the authors demonstrate lower residual energies on 3D spin‑glass instances and improved efficiency on integer factorization tasks. A scaling study shows TAPT reduces the time‑to‑solution exponent by about 33% compared to standard PT across tested problem sizes.
arXiv:2609.22663v1 Announce Type: cross Abstract: Molecular systems have many degrees of freedom, but their metastable behavior can often be described by a few collective variables. Identifying these...
arXiv:2606. 29110v1 Announce Type: new Abstract: Recent progress in flow-based generative modeling has led to models that output high-quality samples while using only a small number of function evaluations.
SimCast‑S2S is a generative latent‑diffusion model designed for probabilistic subseasonal‑to‑seasonal precipitation forecasting. It tackles three key challenges: it uses a diffusion pipeline to capture uncertainty, operates in a compact latent space to enable efficient large‑ensemble generation, and leverages transfer learning with low‑rank adaptation to train on limited reanalysis data after pretraining on climate simulations. The model outperforms deep‑learning baselines and competes with, or surpasses, operational systems such as the ECMWF‑S2S baseline without requiring extensive post‑processing.