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The notion of class is ubiquitous in computer science and is central in many formalisms for the representation of structured knowledge used both in knowledge representation and in databases. In this paper we study the basic issues…

Artificial Intelligence · Computer Science 2011-05-30 D. Calvanese , M. Lenzerini , D. Nardi

Generative modeling has become a central paradigm in protein research, extending machine learning beyond structure prediction toward sequence design, backbone generation, inverse folding, and biomolecular interaction modeling. However, the…

Machine Learning · Computer Science 2026-03-30 Senura Hansaja Wanasekara , Minh-Duong Nguyen , Xiaochen Liu , Nguyen H. Tran , Ken-Tye Yong

The use of machine learning is becoming increasingly common in computational materials science. To build effective models of the chemistry of materials, useful machine-based representations of atoms and their compounds are required. We…

Materials Science · Physics 2021-08-02 Luis M. Antunes , Ricardo Grau-Crespo , Keith T. Butler

We explore a framework for protein sequence representation learning that decomposes the task between manifold learning and distributional modelling. Specifically we present a Latent Space Diffusion architecture which combines a protein…

Machine Learning · Computer Science 2025-03-25 Eoin Quinn , Ghassene Jebali , Maxime Seince , Oliver Bent

Representation and generative learning, as reconstruction-based methods, have demonstrated their potential for mutual reinforcement across various domains. In the field of point cloud processing, although existing studies have adopted…

Computer Vision and Pattern Recognition · Computer Science 2024-08-16 Hongliang Zeng , Ping Zhang , Fang Li , Jiahua Wang , Tingyu Ye , Pengteng Guo

The increasing demand for privacy-preserving machine learning has spurred interest in federated unlearning, which enables the selective removal of data from models trained in federated systems. However, developing federated unlearning…

Machine Learning · Computer Science 2025-05-19 Yang Zhao , Jiaxi Yang , Yiling Tao , Lixu Wang , Xiaoxiao Li , Dusit Niyato , H. Vincent Poor

A common strategy in modern learning systems is to learn a representation that is useful for many tasks, a.k.a. representation learning. We study this strategy in the imitation learning setting for Markov decision processes (MDPs) where…

Machine Learning · Computer Science 2020-02-26 Sanjeev Arora , Simon S. Du , Sham Kakade , Yuping Luo , Nikunj Saunshi

Molecular property prediction integrates quantum chemistry, cheminformatics, and deep learning to connect molecular structure with physicochemical and biological behavior. This survey traces four complementary paradigms, including Quantum,…

Particle filtering is a Bayesian inference method and a fundamental tool in state estimation for dynamic systems, but its effectiveness is often limited by the constraints of the initial prior distribution, a phenomenon we define as the…

Machine Learning · Statistics 2025-01-31 Yiwei Shi , Jingyu Hu , Yu Zhang , Mengyue Yang , Weinan Zhang , Cunjia Liu , Weiru Liu

A variety of representation learning approaches have been investigated for reinforcement learning; much less attention, however, has been given to investigating the utility of sparse coding. Outside of reinforcement learning, sparse coding…

Artificial Intelligence · Computer Science 2017-07-27 Lei Le , Raksha Kumaraswamy , Martha White

Object pose estimation from a single view remains a challenging problem. In particular, partial observability, occlusions, and object symmetries eventually result in pose ambiguity. To account for this multimodality, this work proposes…

Computer Vision and Pattern Recognition · Computer Science 2024-12-03 Christian Möller , Niklas Funk , Jan Peters

We develop a mathematical framework to address a broad class of metric and preference learning problems within a Hilbert space. We obtain a novel representer theorem for the simultaneous task of metric and preference learning. Our key…

Machine Learning · Computer Science 2025-10-28 Peyman Morteza

Recent years have witnessed astonishing advances in the field of multimodal representation learning, with contrastive learning being the cornerstone for major breakthroughs. Latest works delivered further improvements by incorporating…

Computer Vision and Pattern Recognition · Computer Science 2023-02-22 Chaerin Kong , Nojun Kwak

In this paper, we revisit the classical representation of 3D point clouds as linear shape models. Our key insight is to leverage deep learning to represent a collection of shapes as affine transformations of low-dimensional linear shape…

Computer Vision and Pattern Recognition · Computer Science 2021-12-20 Romain Loiseau , Tom Monnier , Mathieu Aubry , Loïc Landrieu

Probabilistic Circuits (PCs) have emerged as an efficient framework for representing and learning complex probability distributions. Nevertheless, the existing body of research on PCs predominantly concentrates on data-driven parameter…

Machine Learning · Computer Science 2024-12-20 Athresh Karanam , Saurabh Mathur , Sahil Sidheekh , Sriraam Natarajan

Automated analyses of the outcome of a simulation have been an important part of atomistic modeling since the early days, addressing the need of linking the behavior of individual atoms and the collective properties that are usually the…

Chemical Physics · Physics 2019-05-22 Michele Ceriotti

We introduce a tensor-based model of shared representation for meta-learning from a diverse set of tasks. Prior works on learning linear representations for meta-learning assume that there is a common shared representation across different…

Machine Learning · Computer Science 2022-01-20 Samuel Deng , Yilin Guo , Daniel Hsu , Debmalya Mandal

Education is a goal-oriented field. But if we want to treat education scientifically so we can accumulate, evaluate, and refine what we learn, then we must develop a theoretical framework that is strongly rooted in objective observations…

Physics Education · Physics 2007-05-23 Edward F. Redish

Unsupervised point cloud completion aims at estimating the corresponding complete point cloud of a partial point cloud in an unpaired manner. It is a crucial but challenging problem since there is no paired partial-complete supervision that…

Computer Vision and Pattern Recognition · Computer Science 2022-03-30 Yingjie Cai , Kwan-Yee Lin , Chao Zhang , Qiang Wang , Xiaogang Wang , Hongsheng Li

Many machine learning algorithms can be interpreted as procedures for estimating functions defined on the data distribution. In this paper we present a conceptual framework that formulates a wide range of learning problems as variational…

Machine Learning · Computer Science 2026-03-17 K. Lakshmanan
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