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Disentanglement is a highly desirable property of representation due to its similarity with human's understanding and reasoning. This improves interpretability, enables the performance of down-stream tasks, and enables controllable…

Machine Learning · Computer Science 2020-10-24 Jiantao Wu , Lin Wang

Deep learning architectures have proved versatile in a number of drug discovery applications, including the modelling of in vitro compound activity. While controlling for prediction confidence is essential to increase the trust,…

Machine Learning · Computer Science 2018-10-23 Isidro Cortes-Ciriano , Andreas Bender

Accurate models are essential for design, performance prediction, control, and diagnostics in complex engineering systems. Physics-based models excel during the design phase but often become outdated during system deployment due to changing…

Machine Learning · Computer Science 2025-01-22 Zihan Liu , Prashant N. Kambali , C. Nataraj

We introduce a novel ensemble approach for feature selection based on hierarchical stacking for non-stationarity and/or a limited number of samples with a large number of features. Our approach exploits the co-dependency between features…

Machine Learning · Computer Science 2024-10-08 Aysin Tumay , Mustafa E. Aydin , Ali T. Koc , Suleyman S. Kozat

We propose an adaptive node feature selection approach for graph neural networks (GNNs) that identifies and removes unnecessary features during training. The ability to measure how features contribute to model output is key for interpreting…

Machine Learning · Computer Science 2026-05-04 Ali Azizpour , Madeline Navarro , Santiago Segarra

Although deep learning models in medical imaging often achieve excellent classification performance, they can rely on shortcut learning, exploiting spurious correlations or confounding factors that are not causally related to the target…

Computer Vision and Pattern Recognition · Computer Science 2026-04-15 Sarah Müller , Philipp Berens

We report an interpretation method for deep learning models that allows us to handle high-dimensional spectral data in materials science. The proposed method uses feature extraction and clustering analysis to categorize materials into…

Materials Science · Physics 2025-10-21 Akira Takahashi , Yu Kumagai , Arata Takamatsu , Fumiyasu Oba

Progress in the application of machine learning techniques to the prediction of solid-state and molecular materials properties has been greatly facilitated by the development state-of-the-art feature representations and novel deep learning…

Materials Science · Physics 2022-03-21 David E. Sommer , Scott T. Dunham

Recently, there is growing attention on one-stage panoptic segmentation methods which aim to segment instances and stuff jointly within a fully convolutional pipeline efficiently. However, most of the existing works directly feed the…

Computer Vision and Pattern Recognition · Computer Science 2022-01-14 Yifeng Chen , Wenqing Chu , Fangfang Wang , Ying Tai , Ran Yi , Zhenye Gan , Liang Yao , Chengjie Wang , Xi Li

Shapley values have emerged as a critical tool for explaining which features impact the decisions made by machine learning models. However, computing exact Shapley values is difficult, generally requiring an exponential (in the feature…

Embedded Feature Selection (FS) is a classical approach for interpretable machine learning, aiming to identify the most relevant features of a dataset while simultaneously training the model. We consider an approach based on a hard…

Optimization and Control · Mathematics 2025-08-01 Federico D'Onofrio , Yuri Faenza , Laura Palagi

Link prediction is central to unraveling social network evolution and node relationships, as well as understanding the characteristic mechanisms of complex networks. Currently, research on link prediction for complex dynamic networks…

Systems and Control · Electrical Eng. & Systems 2026-02-16 Gaoxin Zhang , Ruixing Ren , Junhui Zhao , Xiaoke Sun

In distributed and federated learning, heterogeneity across data sources remains a major obstacle to effective model aggregation and convergence. We focus on feature heterogeneity and introduce energy distance as a sensitive measure for…

Machine Learning · Statistics 2025-01-28 Mengchen Fan , Baocheng Geng , Roman Shterenberg , Joseph A. Casey , Zhong Chen , Keren Li

Feature selection often leads to increased model interpretability, faster computation, and improved model performance by discarding irrelevant or redundant features. While feature selection is a well-studied problem with many widely-used…

Machine Learning · Statistics 2021-02-12 Tianyi Yao , Genevera I. Allen

Feature selection is an important process in machine learning and knowledge discovery. By selecting the most informative features and eliminating irrelevant ones, the performance of learning algorithms can be improved and the extraction of…

Machine Learning · Computer Science 2024-01-17 Chunxu Cao , Qiang Zhang

A powerful and flexible approach to structured prediction consists in embedding the structured objects to be predicted into a feature space of possibly infinite dimension by means of output kernels, and then, solving a regression problem in…

Machine Learning · Statistics 2020-11-03 Luc Brogat-Motte , Alessandro Rudi , Céline Brouard , Juho Rousu , Florence d'Alché-Buc

Probabilistic models help us encode latent structures that both model the data and are ideally also useful for specific downstream tasks. Among these, mixture models and their time-series counterparts, hidden Markov models, identify…

Machine Learning · Computer Science 2021-10-29 Abhishek Sharma , Catherine Zeng , Sanjana Narayanan , Sonali Parbhoo , Finale Doshi-Velez

Interpretable text representations should expose coordinates that are not only predictive, but also meaningful enough for independent auditors to apply. Existing discriminative representations often use anonymous embedding directions, while…

Computation and Language · Computer Science 2026-05-21 Tong Wang , Yiqing Xu , Leo Yang Yang

Regression-based text detection methods have already achieved promising performances with simple network structure and high efficiency. However, they are behind in accuracy comparing with recent segmentation-based text detectors. In this…

Computer Vision and Pattern Recognition · Computer Science 2020-05-27 Zengyuan Guo , Zilin Wang , Zhihui Wang , Wanli Ouyang , Haojie Li , Wen Gao

With the emergence of passive and active optical sensors available for geospatial imaging, information fusion across sensors is becoming ever more important. An important aspect of single (or multiple) sensor geospatial image analysis is…

Computer Vision and Pattern Recognition · Computer Science 2016-07-19 Saurabh Prasad , Minshan Cui , Lifeng Yan