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Predictive models are highly advanced in understanding the mechanisms of brain function. Recent advances in machine learning further underscore the power of prediction for optimal representation in learning. However, there remains a gap in…

Machine Learning · Computer Science 2025-05-22 Xingsi Dong , Xiangyuan Peng , Si Wu

Concept bottleneck models map from raw inputs to concepts, and then from concepts to targets. Such models aim to incorporate pre-specified, high-level concepts into the learning procedure, and have been motivated to meet three desiderata:…

Machine Learning · Computer Science 2021-05-11 Andrei Margeloiu , Matthew Ashman , Umang Bhatt , Yanzhi Chen , Mateja Jamnik , Adrian Weller

Energy-based models (EBMs) are a flexible class of deep generative models and are well-suited to capture complex dependencies in multimodal data. However, learning multimodal EBM by maximum likelihood requires Markov Chain Monte Carlo…

Machine Learning · Computer Science 2026-05-04 Jiali Cui , Zhiqiang Lao , Heather Yu

We introduce Graph Concept Bottleneck (GCB) as a new paradigm for self-explainable text-attributed graph learning. GCB maps graphs into a subspace, concept bottleneck, where each concept is a meaningful phrase, and predictions are made…

Machine Learning · Computer Science 2026-04-15 Xiaoxue Han , Libo Zhang , Zining Zhu , Yue Ning

Deep neural networks with discrete latent variables offer the promise of better symbolic reasoning, and learning abstractions that are more useful to new tasks. There has been a surge in interest in discrete latent variable models, however,…

Machine Learning · Computer Science 2018-07-23 Aurko Roy , Ashish Vaswani , Arvind Neelakantan , Niki Parmar

Discovering the intended items of user queries from a massive repository of items is one of the main goals of an e-commerce search system. Relevance prediction is essential to the search system since it helps improve performance. When…

Information Retrieval · Computer Science 2023-07-21 Jiong Cai , Yong Jiang , Yue Zhang , Chengyue Jiang , Ke Yu , Jianhui Ji , Rong Xiao , Haihong Tang , Tao Wang , Zhongqiang Huang , Pengjun Xie , Fei Huang , Kewei Tu

The increasing use of neural networks in various applications has lead to increasing apprehensions, underscoring the necessity to understand their operations beyond mere final predictions. As a solution to enhance model transparency,…

Machine Learning · Computer Science 2023-11-21 Ivaxi Sheth , Samira Ebrahimi Kahou

We introduce Concept Bottleneck Protein Language Models (CB-pLM), a generative masked language model with a layer where each neuron corresponds to an interpretable concept. Our architecture offers three key benefits: i) Control: We can…

We propose a novel framework for uncertainty quantification via information bottleneck (IB-UQ) for scientific machine learning tasks, including deep neural network (DNN) regression and neural operator learning (DeepONet). Specifically, we…

Numerical Analysis · Mathematics 2023-05-31 Ling Guo , Hao Wu , Wenwen Zhou , Yan Wang , Tao Zhou

Deep learning models are complex due to their size, structure, and inherent randomness in training procedures. Additional complexity arises from the selection of datasets and inductive biases. Addressing these challenges for explainability,…

Continual learning remains a fundamental challenge in machine learning, requiring models to learn from a stream of tasks without forgetting previously acquired knowledge. A major obstacle in this setting is catastrophic forgetting, where…

Computation and Language · Computer Science 2025-12-18 Xiaodi Li , Dingcheng Li , Rujun Gao , Mahmoud Zamani , Feng Mi , Latifur Khan

The Energy-Based Model (EBM) framework is a very general approach to generative modeling that tries to learn and exploit probability distributions only defined though unnormalized scores. It has risen in popularity recently thanks to the…

Machine Learning · Computer Science 2022-02-25 Léo Gagnon , Guillaume Lajoie

The widespread adoption of complex machine learning models in high-stakes domains has brought the "black-box" problem to the forefront of responsible AI research. This paper aims at addressing this issue by improving the Explainable…

Machine Learning · Computer Science 2025-12-02 Isara Liyanage , Uthayasanker Thayasivam

Concept Bottleneck Models (CBMs) aim to enhance interpretability by structuring predictions around human-understandable concepts. However, unintended information leakage, where predictive signals bypass the concept bottleneck, compromises…

Machine Learning · Computer Science 2025-07-22 Mikael Makonnen , Moritz Vandenhirtz , Sonia Laguna , Julia E Vogt

Concept Bottleneck Models (CBMs) have emerged as a cornerstone approach for interpretable machine learning, providing human-understandable intermediate representations through explicit concept activations. However, this interpretability…

Machine Learning · Computer Science 2026-05-26 Aditya Sridhar

Concept Bottleneck Models (CBMs) are machine learning models that improve interpretability by grounding their predictions on human-understandable concepts, allowing for targeted interventions in their decision-making process. However, when…

As the field of quantum physics evolves, researchers naturally form subgroups focusing on specialized problems. While this encourages in-depth exploration, it can limit the exchange of ideas across structurally similar problems in different…

Machine Learning · Computer Science 2024-11-12 Felix Frohnert , Xuemei Gu , Mario Krenn , Evert van Nieuwenburg

Accurately assessing student knowledge is central to education. Cognitive Diagnosis (CD) models estimate student proficiency at a fixed point in time, while Knowledge Tracing (KT) methods model evolving knowledge states to predict future…

Computation and Language · Computer Science 2026-02-10 Antonin Berthon , Mihaela van der Schaar

Concept Bottleneck Models (CBMs) enhance the interpretability of end-to-end neural networks by introducing a layer of concepts and predicting the class label from the concept predictions. A key property of CBMs is that they support…

Machine Learning · Computer Science 2026-03-03 Weixin Chen , Han Zhao

It is necessary to estimate the expected energy usage of a building to determine how to reduce energy usage. The expected energy usage of a building can be reliably simulated using a Building Energy Model (BEM). Many of the numerous input…

Computational Engineering, Finance, and Science · Computer Science 2020-04-21 Arpan Mukherjee , Anna Kuechle Szweda , Andrew Alegria , Rahul Rai , Tarunraj Singh