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Learning motor skills for sports or performance driving is often done with professional instruction from expert human teachers, whose availability is limited. Our goal is to enable automated teaching via a learned model that interacts with…

We present a new method which combines Car-Parrinello and Born-Oppenheimer molecular dynamics in order to accelerate density functional theory based ab-initio simulations. Depending on the system a gain in efficiency of one to two orders of…

Materials Science · Physics 2007-05-23 Thomas D. Kühne , Matthias Krack , Fawzi R. Mohamed , Michele Parrinello

Inertial Measurement Units (IMUs) are interceptive modalities that provide ego-motion measurements independent of the environmental factors. They are widely adopted in various autonomous systems. Motivated by the limitations in processing…

Machine Learning · Computer Science 2021-01-19 Rooholla Khorrambakht , Chris Xiaoxuan Lu , Hamed Damirchi , Zhenghua Chen , Zhengguo Li

Imitation learning enables the synthesis of controllers for complex objectives and highly uncertain plant models. However, methods to provide stability guarantees to imitation learned controllers often rely on large amounts of data and/or…

Systems and Control · Electrical Eng. & Systems 2023-09-14 Amy K. Strong , Ethan J. LoCicero , Leila J. Bridgeman

Imitation learning has proven to be a powerful tool for training complex visuomotor policies. However, current methods often require hundreds to thousands of expert demonstrations to handle high-dimensional visual observations. A key reason…

Robotics · Computer Science 2024-11-01 Zichen Jeff Cui , Hengkai Pan , Aadhithya Iyer , Siddhant Haldar , Lerrel Pinto

We present Integer Linear Programming (ILP) Modulo Theories (IMT). An IMT instance is an Integer Linear Programming instance, where some symbols have interpretations in background theories. In previous work, the IMT approach has been…

Logic in Computer Science · Computer Science 2013-04-09 Panagiotis Manolios , Vasilis Papavasileiou

This paper introduces rotation-equivariance as a self-supervisor to train inertial odometry models. We demonstrate that the self-supervised scheme provides a powerful supervisory signal at training phase as well as at inference stage. It…

Machine Learning · Statistics 2021-11-24 Caifa Zhou , Xiya Cao , Dandan Zeng , Yongliang Wang

In multi-body dynamics, the motion of a complicated physical object is described as a coupled ordinary differential equation system with multiple unknown solutions. Engineers need to constantly adjust the object to meet requirements at the…

Computational Engineering, Finance, and Science · Computer Science 2022-05-26 Wenhao Ding , Qing He , Hanghang Tong , Ping Wang

Spatio-temporal deep learning models aims to utilize useful patterns in such data to support tasks like prediction. However, previous deep learning models designed for specific tasks typically require separate training for each use case,…

Accurately predicting protein fitness with minimal experimental data is a persistent challenge in protein engineering. We introduce PRIMO (PRotein In-context Mutation Oracle), a transformer-based framework that leverages in-context learning…

Biomolecules · Quantitative Biology 2025-12-03 Felix Teufel , Aaron W. Kollasch , Yining Huang , Ole Winther , Kevin K. Yang , Pascal Notin , Debora S. Marks

Machine learning interatomic potentials (MLIPs) offer near-ab initio accuracy with the efficiency of classical force fields, making them attractive for modeling electrolytes. Collecting a diverse training set is essential for their accuracy…

Chemical Physics · Physics 2025-10-07 Olga Chalykh , Mikhail Polovinkin , Dmitry Korogod , Nikita Rybin , Alexander Shapeev

The paper presents a complete pipeline for learning continuous motion control policies for a mobile robot when only a non-differentiable physics simulator of robot-terrain interactions is available. The multi-modal state estimation of the…

Robotics · Computer Science 2022-06-22 Martin Pecka , Karel Zimmermann , Matěj Petrlík , Tomáš Svoboda

Large Multimodal Models (LMMs) exhibit remarkable multi-tasking ability by learning mixed instruction datasets. However, novel tasks would be encountered sequentially in dynamic world, which urges for equipping LMMs with multimodal…

Computer Vision and Pattern Recognition · Computer Science 2025-08-26 Fanhu Zeng , Fei Zhu , Haiyang Guo , Xu-Yao Zhang , Cheng-Lin Liu

Unlike most static material properties widely studied in the machine learning literature, ionic transport properties are inherently dynamic, making their fast and accurate prediction from static atomic structures challenging. The current…

Machine Learning · Computer Science 2026-05-12 Jiyeon Kim , Byungju Lee , Won-Yong Shin

Dynamic Item Response Models extend the standard Item Response Theory (IRT) to capture temporal dynamics in learner ability. While these models have the potential to allow instructional systems to actively monitor the evolution of learner…

Machine Learning · Computer Science 2023-11-16 Yunsung Kim , Sreechan Sankaranarayanan , Chris Piech , Candace Thille

Reaching tasks with random targets and obstacles is a challenging task for robotic manipulators. In this study, we propose a novel model-free reinforcement learning approach based on proximal policy optimization (PPO) for training a deep…

Robotics · Computer Science 2023-02-10 Yongliang Wang , Hamidreza Kasaei

Temporal-difference (TD) learning is highly effective at controlling and evaluating an agent's long-term outcomes. Most approaches in this paradigm implement a semi-gradient update to boost the learning speed, which consists of ignoring the…

Machine Learning · Computer Science 2026-05-15 Théo Vincent , Kevin Gerhardt , Yogesh Tripathi , Habib Maraqten , Adam White , Martha White , Jan Peters , Carlo D'Eramo

Personalized motion planning holds significant importance within urban automated driving, catering to the unique requirements of individual users. Nevertheless, prior endeavors have frequently encountered difficulties in simultaneously…

Robotics · Computer Science 2024-08-06 Fangze Lin , Ying He , Fei Yu

While most ML models expect independent and identically distributed data, this assumption is often violated in real-world scenarios due to distribution shifts, resulting in the degradation of machine learning model performance. Until now,…

Machine Learning · Computer Science 2024-11-19 Kai Helli , David Schnurr , Noah Hollmann , Samuel Müller , Frank Hutter

Neural operators, which emerge as implicit solution operators of hidden governing equations, have recently become popular tools for learning responses of complex real-world physical systems. Nevertheless, the majority of neural operator…

Machine Learning · Computer Science 2023-01-31 Ning Liu , Yue Yu , Huaiqian You , Neeraj Tatikola