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Bayesian inference on structured models typically relies on the ability to infer posterior distributions of underlying hidden variables. However, inference in implicit models or complex posterior distributions is hard. A popular tool for…

Machine Learning · Statistics 2016-12-16 Theofanis Karaletsos

Optimizing deep neural networks (DNNs) often suffers from the ill-conditioned problem. We observe that the scaling-based weight space symmetry property in rectified nonlinear network will cause this negative effect. Therefore, we propose to…

Machine Learning · Computer Science 2017-10-09 Lei Huang , Xianglong Liu , Bo Lang , Bo Li

Graph Neural Networks (GNNs) have demonstrated remarkable effectiveness on graph-based tasks. However, their predictive confidence is often miscalibrated, typically exhibiting under-confidence, which harms the reliability of their…

Machine Learning · Computer Science 2025-09-30 Jincheng Huang , Jie Xu , Xiaoshuang Shi , Ping Hu , Lei Feng , Xiaofeng Zhu

Deep neural nets have caused a revolution in many classification tasks. A related ongoing revolution -- also theoretically not understood -- concerns their ability to serve as generative models for complicated types of data such as images…

Machine Learning · Computer Science 2021-04-20 Holden Lee , Rong Ge , Tengyu Ma , Andrej Risteski , Sanjeev Arora

We present a novel computational approach for extracting weak signals, whose exact location and width may be unknown, from complex background distributions with an arbitrary functional form. We focus on datasets that can be naturally…

High Energy Physics - Experiment · Physics 2023-03-22 Abhijith Gandrakota , Amitabh Lath , Alexandre V. Morozov , Sindhu Murthy

In the context of multivariate nonparametric regression with missing covariates, we propose Pattern Embedded Neural Networks (PENNs), which can be applied in conjunction with any existing imputation technique. In addition to a neural…

Methodology · Statistics 2025-04-30 Tianyi Ma , Tengyao Wang , Richard J. Samworth

Despite exceptional predictive performance of Deep sequence models (DSMs), the main concern of their deployment centers around the lack of uncertainty awareness. In contrast, probabilistic models quantify the uncertainty associated with…

Machine Learning · Computer Science 2026-03-03 Wenlong Chen

Multi-layered representation is believed to be the key ingredient of deep neural networks especially in cognitive tasks like computer vision. While non-differentiable models such as gradient boosting decision trees (GBDTs) are the dominant…

Machine Learning · Computer Science 2020-07-07 Ji Feng , Yang Yu , Zhi-Hua Zhou

This is a tutorial and survey paper on Boltzmann Machine (BM), Restricted Boltzmann Machine (RBM), and Deep Belief Network (DBN). We start with the required background on probabilistic graphical models, Markov random field, Gibbs sampling,…

Machine Learning · Computer Science 2022-08-09 Benyamin Ghojogh , Ali Ghodsi , Fakhri Karray , Mark Crowley

Cellular systems are becoming more heterogeneous with the introduction of low power nodes including femtocells, relays, and distributed antennas. Unfortunately, the resulting interference environment is also becoming more complicated,…

Information Theory · Computer Science 2013-04-29 Robert W. Heath , Marios Kountouris , Tianyang Bai

While Bayesian neural networks (BNNs) hold the promise of being flexible, well-calibrated statistical models, inference often requires approximations whose consequences are poorly understood. We study the quality of common variational…

Machine Learning · Statistics 2020-10-26 Andrew Y. K. Foong , David R. Burt , Yingzhen Li , Richard E. Turner

We propose a general framework called Network Dissection for quantifying the interpretability of latent representations of CNNs by evaluating the alignment between individual hidden units and a set of semantic concepts. Given any CNN model,…

Computer Vision and Pattern Recognition · Computer Science 2017-04-20 David Bau , Bolei Zhou , Aditya Khosla , Aude Oliva , Antonio Torralba

This paper considers inference over distributed linear Gaussian models using factor graphs and Gaussian belief propagation (BP). The distributed inference algorithm involves only local computation of the information matrix and of the mean…

Machine Learning · Statistics 2018-01-01 Jian Du , Shaodan Ma , Yik-Chung Wu , Soummya Kar , José M. F. Moura

Accurate prediction of blood-brain barrier permeability (BBBP) is essential for central nervous system (CNS) drug development. While graph neural networks (GNNs) have advanced molecular property prediction, they often rely on molecular…

Machine Learning · Computer Science 2025-12-09 Trung Nguyen , Md Masud Rana , Farjana Tasnim Mukta , Chang-Guo Zhan , Duc Duy Nguyen

Much of the recent work on learning molecular representations has been based on Graph Convolution Networks (GCN). These models rely on local aggregation operations and can therefore miss higher-order graph properties. To remedy this, we…

Machine Learning · Computer Science 2019-05-31 Benson Chen , Regina Barzilay , Tommi Jaakkola

As proteins with similar structures often have similar functions, analysis of protein structures can help predict protein functions and is thus important. We consider the problem of protein structure classification, which computationally…

Machine Learning · Statistics 2019-10-08 Hongyu Guo , Khalique Newaz , Scott Emrich , Tijana Milenkovic , Jun Li

In many real-world problems, there is a limited set of training data, but an abundance of unlabeled data. We propose a new method, Generative Posterior Networks (GPNs), that uses unlabeled data to estimate epistemic uncertainty in…

Machine Learning · Computer Science 2024-01-01 Melrose Roderick , Felix Berkenkamp , Fatemeh Sheikholeslami , Zico Kolter

Implicit neural representations have shown potential in various applications. However, accurately reconstructing the image or providing clear details via image super-resolution remains challenging. This paper introduces Quantum Fourier…

Quantum Physics · Physics 2025-04-29 Hongni Jin , Gurinder Singh , Kenneth M. Merz

To understand the spatial deployment of base stations (BSs) is the first step to analyze the performance of cellular networks and further design efficient networking protocols. Poisson point process (PPP), which has been widely adopted to…

Information Theory · Computer Science 2018-11-20 Rongpeng Li , Zhifeng Zhao , Yi Zhong , Chen Qi , Honggang Zhang

We propose a fast and scalable variational method for Bayesian inference in high-dimensional parameter space, which we call projected Stein variational Newton (pSVN) method. We exploit the intrinsic low-dimensional geometric structure of…

Optimization and Control · Mathematics 2020-02-11 Peng Chen , Keyi Wu , Joshua Chen , Thomas O'Leary-Roseberry , Omar Ghattas
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