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Autoregressive generative models are commonly used, especially for those tasks involving sequential data. They have, however, been plagued by a slew of inherent flaws due to the intrinsic characteristics of chain-style conditional modeling…

Machine Learning · Computer Science 2022-06-28 Yezhen Wang , Tong Che , Bo Li , Kaitao Song , Hengzhi Pei , Yoshua Bengio , Dongsheng Li

Anomaly detection is referred to as a process in which the aim is to detect data points that follow a different pattern from the majority of data points. Anomaly detection methods suffer from several well-known challenges that hinder their…

Machine Learning · Computer Science 2021-08-31 Kasra Babaei , Zhi Yuan Chen , Tomas Maul

Unlike most static material properties widely studied in the machine learning literature, ionic transport properties are inherently dynamic, making their fast and accurate prediction from static atomic structures challenging. The current…

Machine Learning · Computer Science 2026-05-12 Jiyeon Kim , Byungju Lee , Won-Yong Shin

We present a forward sufficient dimension reduction method for categorical or ordinal responses by extending the outer product of gradients and minimum average variance estimator to multinomial generalized linear model. Previous work in…

Methodology · Statistics 2023-03-30 Harris Quach , Bing Li

Neural networks are achieving state of the art and sometimes super-human performance on learning tasks across a variety of domains. Whenever these problems require learning in a continual or sequential manner, however, neural networks…

Machine Learning · Computer Science 2019-10-17 Mehrdad Farajtabar , Navid Azizan , Alex Mott , Ang Li

The quantification of uncertainty is important for the adoption of machine learning, especially to reject out-of-distribution (OOD) data back to human experts for review. Yet progress has been slow, as a balance must be struck between…

Machine Learning · Computer Science 2022-09-12 Derek Everett , Andre T. Nguyen , Luke E. Richards , Edward Raff

While data are the primary fuel for machine learning models, they often suffer from missing values, especially when collected in real-world scenarios. However, many off-the-shelf machine learning models, including artificial neural network…

Neural differential equations may be trained by backpropagating gradients via the adjoint method, which is another differential equation typically solved using an adaptive-step-size numerical differential equation solver. A proposed step is…

Machine Learning · Computer Science 2021-05-11 Patrick Kidger , Ricky T. Q. Chen , Terry Lyons

Neural Ordinary Differential Equations (NODEs) have proven to be a powerful modeling tool for approximating (interpolation) and forecasting (extrapolation) irregularly sampled time series data. However, their performance degrades…

Machine Learning · Computer Science 2020-04-29 Hammad A. Ayyubi , Yi Yao , Ajay Divakaran

Neural networks (NNs) are widely used for object classification in autonomous driving. However, NNs can fail on input data not well represented by the training dataset, known as out-of-distribution (OOD) data. A mechanism to detect OOD…

Computer Vision and Pattern Recognition · Computer Science 2021-09-07 Julia Nitsch , Masha Itkina , Ransalu Senanayake , Juan Nieto , Max Schmidt , Roland Siegwart , Mykel J. Kochenderfer , Cesar Cadena

Uncertainty estimation aims to evaluate the confidence of a trained deep neural network. However, existing uncertainty estimation approaches rely on low-dimensional distributional assumptions and thus suffer from the high dimensionality of…

Machine Learning · Computer Science 2023-10-26 Tsai Hor Chan , Kin Wai Lau , Jiajun Shen , Guosheng Yin , Lequan Yu

Explicit deep generative models (DGMs), e.g., VAEs and Normalizing Flows, have shown to offer an effective data modelling alternative for lossless compression. However, DGMs themselves normally require large storage space and thus…

Machine Learning · Computer Science 2021-11-03 Chen Zhang , Shifeng Zhang , Fabio Maria Carlucci , Zhenguo Li

Class-conditional generative models have emerged as accurate and robust classifiers, with diffusion models demonstrating clear advantages over other visual generative paradigms, including autoregressive (AR) models. In this work, we revisit…

Computer Vision and Pattern Recognition · Computer Science 2026-03-20 Ilia Sudakov , Artem Babenko , Dmitry Baranchuk

Gradient-based learning algorithms have an implicit simplicity bias which in effect can limit the diversity of predictors being sampled by the learning procedure. This behavior can hinder the transferability of trained models by (i)…

Machine Learning · Computer Science 2022-11-24 Matteo Pagliardini , Martin Jaggi , François Fleuret , Sai Praneeth Karimireddy

We explore in detail a method to solve ordinary differential equations using feedforward neural networks. We prove a specific loss function, which does not require knowledge of the exact solution, to be a suitable standard metric to…

Computational Physics · Physics 2020-06-02 Liam L. H. Lau , Denis Werth

Training of deep neural networks (DNNs) frequently involves optimizing several millions or even billions of parameters. Even with modern computing architectures, the computational expense of DNN training can inhibit, for instance, network…

Machine Learning · Computer Science 2020-06-26 Mauricio E. Tano , Gavin D. Portwood , Jean C. Ragusa

Autoregressively trained transformers have brought a profound revolution to the world, especially with their in-context learning (ICL) ability to address downstream tasks. Recently, several studies suggest that transformers learn a…

Machine Learning · Computer Science 2024-10-29 Chenyu Zheng , Wei Huang , Rongzhen Wang , Guoqiang Wu , Jun Zhu , Chongxuan Li

Ordinal regression is a classification task where classes have an order and prediction error increases the further the predicted class is from the true class. The standard approach for modeling ordinal data involves fitting parallel…

Machine Learning · Computer Science 2022-02-16 Fred Lu , Francis Ferraro , Edward Raff

To acquire a new skill, humans learn better and faster if a tutor, based on their current knowledge level, informs them of how much attention they should pay to particular content or practice problems. Similarly, a machine learning model…

Machine Learning · Computer Science 2021-06-18 Xinyi Wang , Hieu Pham , Paul Michel , Antonios Anastasopoulos , Jaime Carbonell , Graham Neubig

We consider the problem of learning Variational Autoencoders (VAEs), i.e., a type of deep generative model, from data with missing values. Such data is omnipresent in real-world applications of machine learning because complete data is…

Machine Learning · Computer Science 2023-10-26 Timur Sudak , Sebastian Tschiatschek