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This paper studies a curious phenomenon in learning energy-based model (EBM) using MCMC. In each learning iteration, we generate synthesized examples by running a non-convergent, non-mixing, and non-persistent short-run MCMC toward the…

Machine Learning · Statistics 2019-11-27 Erik Nijkamp , Mitch Hill , Song-Chun Zhu , Ying Nian Wu

Energy-based models provide a natural bridge between statistical physics and machine learning by representing data through structured energy landscapes. Boltzmann machines are a particularly compelling class of such models for capturing…

Quantum Physics · Physics 2026-05-19 Gilhan Kim , Daniel K. Park

We present a new statistical learning paradigm for Boltzmann machines based on a new inference principle we have proposed: the latent maximum entropy principle (LME). LME is different both from Jaynes maximum entropy principle and from…

Machine Learning · Computer Science 2012-12-12 Shaojun Wang , Dale Schuurmans , Fuchun Peng , Yunxin Zhao

Despite their appeal as physics-inspired, energy-based and generative nature, general Boltzmann Machines (BM) are considered intractable to train. This belief led to simplified models of BMs with restricted intralayer connections or…

Emerging Technologies · Computer Science 2024-01-05 Shuvro Chowdhury , Shaila Niazi , Kerem Y. Camsari

Developing an efficient sampler capable of generating independent and identically distributed (IID) samples from a Boltzmann distribution is a crucial challenge in scientific research, e.g. molecular dynamics. In this work, we intend to…

Machine Learning · Computer Science 2026-03-10 RuiKang OuYang , Bo Qiang , José Miguel Hernández-Lobato

Standard contrastive learning approaches usually require a large number of negatives for effective unsupervised learning and often exhibit slow convergence. We suspect this behavior is due to the suboptimal selection of negatives used for…

Machine Learning · Computer Science 2021-12-22 Anshul Shah , Suvrit Sra , Rama Chellappa , Anoop Cherian

Lattice Boltzmann methods are a popular mesoscopic alternative to macroscopic computational fluid dynamics solvers. Many variants have been developed that vary in complexity, accuracy, and computational cost. Extensions are available to…

Mathematical Software · Computer Science 2020-04-14 Martin Bauer , Harald Köstler , Ulrich Rüde

Training generative models to sample from unnormalized density functions is an important and challenging task in machine learning. Traditional training methods often rely on the reverse Kullback-Leibler (KL) divergence due to its…

Machine Learning · Computer Science 2025-03-05 Jiajun He , Wenlin Chen , Mingtian Zhang , David Barber , José Miguel Hernández-Lobato

Estimating the log-likelihood gradient with respect to the parameters of a Restricted Boltzmann Machine (RBM) typically requires sampling using Markov Chain Monte Carlo (MCMC) techniques. To save computation time, the Markov chains are only…

Machine Learning · Computer Science 2017-06-29 Oswin Krause , Asja Fischer , Christian Igel

Contrastive learning is a well-established paradigm in representation learning. The standard framework of contrastive learning minimizes the distance between "similar" instances and maximizes the distance between dissimilar ones in the…

Machine Learning · Computer Science 2025-02-06 Naghmeh Ghanooni , Barbod Pajoum , Harshit Rawal , Sophie Fellenz , Vo Nguyen Le Duy , Marius Kloft

Lattice Boltzmann method (LBM) is a promising approach to solving Computational Fluid Dynamics (CFD) problems, however, its nature of memory-boundness limits nearly all LBM algorithms' performance on modern computer architectures. This…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-08-11 Yuankun Fu , Fengguang Song

The restricted Boltzmann machine (RBM) is a representative generative model based on the concept of statistical mechanics. In spite of the strong merit of interpretability, unavailability of backpropagation makes it less competitive than…

Computer Vision and Pattern Recognition · Computer Science 2020-11-30 Juno Hwang , Wonseok Hwang , Junghyo Jo

The success of any machine learning system depends critically on effective representations of data. In many cases, it is desirable that a representation scheme uncovers the parts-based, additive nature of the data. Of current representation…

Machine Learning · Computer Science 2017-08-21 Tu Dinh Nguyen , Truyen Tran , Dinh Phung , Svetha Venkatesh

The possibility of employing restricted Boltzmann machine (RBM) for collaborative filtering has been known for about a decade. However, there has been hardly any work on this topic since 2007. This work revisits the application of RBM in…

Machine Learning · Computer Science 2019-10-18 Sagar Verma , Prince Patel , Angshul Majumdar

We applied our previously developed library-based Monte Carlo (LBMC) to equilibrium sampling of several implicitly solvated all-atom peptides. LBMC can perform equilibrium sampling of molecules using the pre-calculated statistical libraries…

Biological Physics · Physics 2015-05-14 Ying Ding , Artem B. Mamonov , Daniel M. Zuckerman

Stochastic neural networks such as Restricted Boltzmann Machines (RBMs) have been successfully used in applications ranging from speech recognition to image classification. Inference and learning in these algorithms use a Markov Chain Monte…

Neural and Evolutionary Computing · Computer Science 2016-11-17 Bruno U. Pedroni , Srinjoy Das , John V. Arthur , Paul A. Merolla , Bryan L. Jackson , Dharmendra S. Modha , Kenneth Kreutz-Delgado , Gert Cauwenberghs

Understanding the results of deep neural networks is an essential step towards wider acceptance of deep learning algorithms. Many approaches address the issue of interpreting artificial neural networks, but often provide divergent…

Machine Learning · Computer Science 2021-11-16 Vadim Borisov , Johannes Meier , Johan van den Heuvel , Hamed Jalali , Gjergji Kasneci

The lattice Boltzmann method exhibits excellent scalability on current supercomputing systems and has thus increasingly become an alternative method for large-scale non-stationary flow simulations, reaching up to a trillion grid nodes.…

Distributed, Parallel, and Cluster Computing · Computer Science 2016-05-11 Florian Schornbaum , Ulrich Rüde

Bayesian max-margin models have shown superiority in various practical applications, such as text categorization, collaborative prediction, social network link prediction and crowdsourcing, and they conjoin the flexibility of Bayesian…

Machine Learning · Statistics 2016-10-19 Wenbo Hu , Jun Zhu , Bo Zhang

Boltzmann machines are physics informed generative models with wide applications in machine learning. They can learn the probability distribution from an input dataset and generate new samples accordingly. Applying them back to physics, the…

Computational Physics · Physics 2017-11-20 Lei Wang