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Biomarker discovery is vital in advancing personalized medicine, offering insights into disease diagnosis, prognosis, and therapeutic efficacy. Traditionally, the identification and validation of biomarkers heavily depend on extensive…

Machine Learning · Computer Science 2024-09-25 Wangyang Ying , Dongjie Wang , Xuanming Hu , Ji Qiu , Jin Park , Yanjie Fu

End-to-End (E2E) planning has become a powerful paradigm for autonomous driving, yet current systems remain fundamentally uncertainty-blind. They assume perception outputs are fully reliable, even in ambiguous or poorly observed scenes,…

Robotics · Computer Science 2025-12-01 Wonjeong Ryu , Seungjun Yu , Seokha Moon , Hojun Choi , Junsung Park , Jinkyu Kim , Hyunjung Shim

The Science of Science (SoS) explores the mechanisms underlying scientific discovery, and offers valuable insights for enhancing scientific efficiency and fostering innovation. Traditional approaches often rely on simplistic assumptions and…

Artificial Intelligence · Computer Science 2025-05-20 Renqi Chen , Haoyang Su , Shixiang Tang , Zhenfei Yin , Qi Wu , Hui Li , Ye Sun , Nanqing Dong , Wanli Ouyang , Philip Torr

Science laboratory automation enables accelerated discovery in life sciences and materials. However, it requires interdisciplinary collaboration to address challenges such as robust and flexible autonomy, reproducibility, throughput,…

A common belief in designing deep autoencoders (AEs), a type of unsupervised neural network, is that a bottleneck is required to prevent learning the identity function. Learning the identity function renders the AEs useless for anomaly…

Machine Learning · Computer Science 2022-02-28 Bang Xiang Yong , Alexandra Brintrup

Artificial Intelligence (AI) is accelerating the transformation of scientific research paradigms, not only enhancing research efficiency but also driving innovation. We introduce InternAgent, a unified closed-loop multi-agent framework to…

Traditional information theory provides a valuable foundation for Reinforcement Learning, particularly through representation learning and entropy maximization for agent exploration. However, existing methods primarily concentrate on…

Machine Learning · Computer Science 2024-10-10 Xianghua Zeng , Hao Peng , Angsheng Li

Here we propose the Reweighted Autoencoded Variational Bayes for Enhanced Sampling (RAVE) method, a new iterative scheme that uses the deep learning framework of variational autoencoders to enhance sampling in molecular simulations. RAVE…

Chemical Physics · Physics 2018-02-13 Joao Marcelo Lamim Ribeiro , Pablo Bravo Collado , Yihang Wang , Pratyush Tiwary

Deep learning and deep architectures are emerging as the best machine learning methods so far in many practical applications such as reducing the dimensionality of data, image classification, speech recognition or object segmentation. In…

Machine Learning · Computer Science 2018-07-10 The-Hien Dang-Ha

Automatic medical image segmentation plays a critical role in scientific research and medical care. Existing high-performance deep learning methods typically rely on large training datasets with high-quality manual annotations, which are…

Image and Video Processing · Electrical Eng. & Systems 2021-11-17 Shanshan Wang , Cheng Li , Rongpin Wang , Zaiyi Liu , Meiyun Wang , Hongna Tan , Yaping Wu , Xinfeng Liu , Hui Sun , Rui Yang , Xin Liu , Jie Chen , Huihui Zhou , Ismail Ben Ayed , Hairong Zheng

End-to-end autonomous driving has emerged as a promising paradigm for directly mapping sensor inputs to planning maneuvers using learning-based modular integrations. However, existing imitation learning (IL)-based models suffer from…

Robotics · Computer Science 2025-06-12 Haochen Liu , Tianyu Li , Haohan Yang , Li Chen , Caojun Wang , Ke Guo , Haochen Tian , Hongchen Li , Hongyang Li , Chen Lv

How can we detect anomalies: that is, samples that significantly differ from a given set of high-dimensional data, such as images or sensor data? This is a practical problem with numerous applications and is also relevant to the goal of…

Machine Learning · Computer Science 2022-06-16 Adam Goodge , Bryan Hooi , See Kiong Ng , Wee Siong Ng

Application of artificial intelligence (AI), and more specifically machine learning, to the physical sciences has expanded significantly over the past decades. In particular, science-informed AI, also known as scientific AI or inductive…

The advancement of artificial-intelligence driven autonomous experiments demands physics-based modeling and decision-making processes, not only to improve the accuracy of the experimental trajectory but also to increase trust by allowing…

Soft Condensed Matter · Physics 2025-06-18 Duncan R. Sutherland , Rachel Ford , Yun Liu , Tyler B. Martin , Peter A. Beaucage

We present a novel Artificial Intelligence approach for Beyond the Standard Model parameter space scans by augmenting an Evolutionary Strategy with Novelty Detection. Our approach leverages the power of Evolutionary Strategies, previously…

High Energy Physics - Phenomenology · Physics 2025-03-10 Jorge Crispim Romão , Miguel Crispim Romão

Anomaly detection without priors of the anomalies is challenging. In the field of unsupervised anomaly detection, traditional auto-encoder (AE) tends to fail based on the assumption that by training only on normal images, the model will not…

Computer Vision and Pattern Recognition · Computer Science 2024-08-15 Yajie Cui , Zhaoxiang Liu , Shiguo Lian

Customized hardware accelerators have been developed to provide improved performance and efficiency for DNN inference and training. However, the existing hardware accelerators may not always be suitable for handling various DNN models as…

Hardware Architecture · Computer Science 2021-04-07 Xiaofan Zhang , Hanchen Ye , Deming Chen

In industry, machine anomalous sound detection (ASD) is in great demand. However, collecting enough abnormal samples is difficult due to the high cost, which boosts the rapid development of unsupervised ASD algorithms. Autoencoder (AE)…

Sound · Computer Science 2023-11-16 Yifan Zhou , Dongxing Xu , Haoran Wei , Yanhua Long

The broad adoption of machine learning (ML)-based automated and autonomous experiments (AE) in physical characterization and synthesis requires development of strategies for understanding and intervention in the experimental workflow. Here,…

Materials Science · Physics 2024-11-15 Yongtao Liu , Maxim Ziatdinov , Rama Vasudevan , Sergei V. Kalinin

The lack of evidence for new physics at the Large Hadron Collider so far has prompted the development of model-independent search techniques. In this study, we compare the anomaly scores of a variety of anomaly detection techniques: an…