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Molecule representation learning is crucial for understanding and predicting molecular properties. However, conventional atom-centric models, which treat chemical bonds merely as pairwise interactions, often overlook complex bond-level…

Machine Learning · Computer Science 2026-03-03 Yunqing Liu , Yi Zhou , Wenqi Fan

What does it mean for a machine to recognize beauty? While beauty remains a culturally and experientially compelling but philosophically elusive concept, deep learning systems increasingly appear capable of modeling aesthetic judgment. In…

Computers and Society · Computer Science 2026-03-18 Alexander Michael Rusnak

We study the problem of learning permutation invariant representations that can capture "flexible" notions of containment. We formalize this problem via a measure theoretic definition of multisets, and obtain a theoretically-motivated…

Machine Learning · Computer Science 2019-11-21 Vasco Portilheiro

Over the past decade, deep learning has proven to be a highly effective tool for learning meaningful features from raw data. However, it remains an open question how deep networks perform hierarchical feature learning across layers. In this…

Machine Learning · Computer Science 2025-11-17 Peng Wang , Xiao Li , Can Yaras , Zhihui Zhu , Laura Balzano , Wei Hu , Qing Qu

Recent deep-learning models have achieved impressive predictive performance by learning complex functions of many variables, often at the cost of interpretability. This chapter covers recent work aiming to interpret models by attributing…

Machine Learning · Statistics 2021-08-20 Chandan Singh , Wooseok Ha , Bin Yu

This paper investigates the idea of encoding object-centered representations in the design of the reward function and policy architectures of a language-guided reinforcement learning agent. This is done using a combination of object-wise…

Machine Learning · Computer Science 2020-04-20 Tristan Karch , Cédric Colas , Laetitia Teodorescu , Clément Moulin-Frier , Pierre-Yves Oudeyer

Cross-domain recommendation has long been one of the major topics in recommender systems. Recently, various deep models have been proposed to transfer the learned knowledge across domains, but most of them focus on extracting abstract…

Machine Learning · Computer Science 2019-05-28 Feng Yuan , Lina Yao , Boualem Benatallah

Transformers are deep neural network architectures that underpin the recent successes of large language models. Unlike more classical architectures that can be viewed as point-to-point maps, a Transformer acts as a measure-to-measure map…

Optimization and Control · Mathematics 2026-02-16 Borjan Geshkovski , Philippe Rigollet , Domènec Ruiz-Balet

In this paper, we propose to provide a general ensemble learning framework based on deep learning models. Given a group of unit models, the proposed deep ensemble learning framework will effectively combine their learning results via a…

Machine Learning · Computer Science 2018-05-22 Jiawei Zhang , Limeng Cui , Fisher B. Gouza

In this paper we present a unified framework for modeling multi-relational representations, scoring, and learning, and conduct an empirical study of several recent multi-relational embedding models under the framework. We investigate the…

Computation and Language · Computer Science 2014-11-18 Bishan Yang , Wen-tau Yih , Xiaodong He , Jianfeng Gao , Li Deng

This paper presents the design of deep learning architectures which allow to classify the social relationship existing between two people who are walking in a side-by-side formation into four possible categories --colleagues, couple, family…

Machine Learning · Computer Science 2022-07-08 Oscar Castro , Ely Repiso , Anais Garrell , Alberto Sanfeliu

To plan safe maneuvers and act with foresight, autonomous vehicles must be capable of accurately predicting the uncertain future. In the context of autonomous driving, deep neural networks have been successfully applied to learning…

Robotics · Computer Science 2022-08-02 Salar Arbabi , Davide Tavernini , Saber Fallah , Richard Bowden

Human vision models are at the core of image processing. For instance, classical approaches to the problem of image quality are based on models that include knowledge about human vision. However, nowadays, deep learning approaches have…

Computer Vision and Pattern Recognition · Computer Science 2025-05-20 Jorge Vila-Tomás , Pablo Hernández-Cámara , Valero Laparra , Jesús Malo

Recognizing spatial relations and reasoning about them is essential in multiple applications including navigation, direction giving and human-computer interaction in general. Spatial relations between objects can either be explicit --…

Computation and Language · Computer Science 2020-07-21 Soham Dan , Hangfeng He , Dan Roth

Identifying common patterns among events is a key ability in human and machine perception, as it underlies intelligent decision making. We propose an approach for learning semantic relational set abstractions on videos, inspired by human…

Computer Vision and Pattern Recognition · Computer Science 2020-08-14 Alex Andonian , Camilo Fosco , Mathew Monfort , Allen Lee , Rogerio Feris , Carl Vondrick , Aude Oliva

Deep metric learning maps visually similar images onto nearby locations and visually dissimilar images apart from each other in an embedding manifold. The learning process is mainly based on the supplied image negative and positive training…

Computer Vision and Pattern Recognition · Computer Science 2020-09-14 Chang-Hui Liang , Wan-Lei Zhao , Run-Qing Chen

Speech encodes a wealth of information related to human behavior and has been used in a variety of automated behavior recognition tasks. However, extracting behavioral information from speech remains challenging including due to inadequate…

Audio and Speech Processing · Electrical Eng. & Systems 2021-04-09 Haoqi Li , Brian Baucom , Shrikanth Narayanan , Panayiotis Georgiou

Humans learn about objects via interaction and using multiple perceptions, such as vision, sound, and touch. While vision can provide information about an object's appearance, non-visual sensors, such as audio and haptics, can provide…

Robotics · Computer Science 2023-09-18 Gyan Tatiya , Jonathan Francis , Jivko Sinapov

Machine learning models have become firmly established across all scientific fields. Extracting features from data and making inferences based on them with neural network models often yields high accuracy; however, this approach has several…

Machine Learning · Computer Science 2026-01-13 Mikhail Lazarev , Andrey Ustyuzhanin

The functions of proteins and RNAs are determined by a myriad of interactions between their constituent residues, but most quantitative models of how molecular phenotype depends on genotype must approximate this by simple additive effects.…

Quantitative Methods · Quantitative Biology 2017-12-19 Adam J. Riesselman , John B. Ingraham , Debora S. Marks
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