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Related papers: Beyond Optimization: Exploring Novelty Discovery i…

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Novelty detection in large scientific datasets faces two key challenges: the noisy and high-dimensional nature of experimental data, and the necessity of making statistically robust statements about any observed outliers. While there is a…

Active event perception, the ability to dynamically detect, track, and summarize events in real time, is essential for embodied intelligence in tasks such as human-AI collaboration, assistive robotics, and autonomous navigation. However,…

Robotics · Computer Science 2025-06-24 Zhou Chen , Sanjoy Kundu , Harsimran S. Baweja , Sathyanarayanan N. Aakur

Both computational and experimental material discovery bring forth the challenge of exploring multidimensional and multimodal parameter spaces, such as phase diagrams of Hamiltonians with multiple interactions, composition spaces of…

Machine Learning · Computer Science 2024-09-20 Arpan Biswas , Rama Vasudevan , Rohit Pant , Ichiro Takeuchi , Hiroshi Funakubo , Yongtao Liu

Autonomous experimentation (AE) combines machine learning and research hardware automation in a closed loop, guiding subsequent experiments toward user goals. As applied to materials research, AE can accelerate materials exploration,…

Materials Science · Physics 2023-06-21 Felix Adams , Austin McDannald , Ichiro Takeuchi , A. Gilad Kusne

Autoencoders (AE) have recently been widely employed to approach the novelty detection problem. Trained only on the normal data, the AE is expected to reconstruct the normal data effectively while fail to regenerate the anomalous data,…

Computer Vision and Pattern Recognition · Computer Science 2020-10-27 Mohammadreza Salehi , Atrin Arya , Barbod Pajoum , Mohammad Otoofi , Amirreza Shaeiri , Mohammad Hossein Rohban , Hamid R. Rabiee

Machine learning and artificial intelligence (ML/AI) are rapidly becoming an indispensable part of physics research, with domain applications ranging from theory and materials prediction to high-throughput data analysis. In parallel, the…

An innovations sequence of a time series is a sequence of independent and identically distributed random variables with which the original time series has a causal representation. The innovation at a time is statistically independent of the…

Machine Learning · Statistics 2024-05-01 Xinyi Wang , Lang Tong

Reward-based optimization algorithms require both exploration, to find rewards, and exploitation, to maximize performance. The need for efficient exploration is even more significant in sparse reward settings, in which performance feedback…

Neural and Evolutionary Computing · Computer Science 2021-04-19 Giuseppe Paolo , Alexandre Coninx , Stephane Doncieux , Alban Laflaquière

Automated anomaly detection is essential for managing information and communications technology (ICT) systems to maintain reliable services with minimum burden on operators. For detecting varying and continually emerging anomalies as…

Machine Learning · Statistics 2018-12-19 Yasuhiro Ikeda , Keisuke Ishibashi , Yuusuke Nakano , Keishiro Watanabe , Ryoichi Kawahara

Causal inference is central to scientific discovery, yet choosing appropriate methods remains challenging because of the complexity of both statistical methodology and real-world data. Inspired by the success of artificial intelligence in…

Artificial Intelligence · Computer Science 2026-04-07 Can Wang , Hongyu Zhao , Yiqun Chen

Detecting rare and diverse anomalies in highly imbalanced datasets-such as Advanced Persistent Threats (APTs) in cybersecurity-remains a fundamental challenge for machine learning systems. Active learning offers a promising direction by…

Machine Learning · Computer Science 2026-02-04 Sidahmed Benabderrahmane , Petko Valtchev , James Cheney , Talal Rahwan

In machine learning, novelty detection is the task of identifying novel unseen data. During training, only samples from the normal class are available. Test samples are classified as normal or abnormal by assignment of a novelty score. Here…

Novelty search (NS) refers to a class of exploration algorithms that seek to uncover diverse system behaviors through simulations or experiments. Such diversity is central to many AI-driven discovery and design tasks, including material and…

Machine Learning · Statistics 2025-07-31 Wei-Ting Tang , Ankush Chakrabarty , Joel A. Paulson

Automated decision-making is becoming key for automated characterization including electron and scanning probe microscopies and nano indentation. Most machine learning driven workflows optimize a single predefined objective and tend to…

Materials Science · Physics 2026-04-07 Kamyar Barakati , Boris N. Slautin , Utkarsh Pratiush , Hiroshi Funakubo , Sergei V. Kalinin

Modern automated microscopy faces a fundamental discovery challenge: in many systems, the most important scientific information does not reside in the immediately visible image features, but in the target space of sequentially acquired…

Scientific research is being reshaped by AI systems that move beyond isolated assistance toward longer-horizon workflows spanning literature grounding, hypothesis generation, experimentation, validation, reporting, and revision. This shift…

Scientific discovery increasingly entails long-horizon exploration of complex hypothesis spaces, yet most existing approaches emphasize final performance while offering limited insight into how scientific exploration unfolds over time,…

The performance of current supervised AI systems is tightly connected to the availability of annotated datasets. Annotations are usually collected through annotation tools, which are often designed for specific tasks and are difficult to…

Human-Computer Interaction · Computer Science 2023-05-24 Naihao Deng , Yikai Liu , Mingye Chen , Winston Wu , Siyang Liu , Yulong Chen , Yue Zhang , Rada Mihalcea

We present a new approach for efficient exploration which leverages a low-dimensional encoding of the environment learned with a combination of model-based and model-free objectives. Our approach uses intrinsic rewards that are based on the…

Machine Learning · Computer Science 2022-04-18 Ruo Yu Tao , Vincent François-Lavet , Joelle Pineau

The challenge of optimal design of experiments (DOE) pervades materials science, physics, chemistry, and biology. Bayesian optimization has been used to address this challenge in vast sample spaces, although it requires framing experimental…

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