Reward shaping is a critical component in reinforcement learning (RL), particularly for complex tasks where sparse rewards can hinder learning. While shaping rewards have been introduced to provide additional guidance, selecting effective shaping functions remains challenging and computationally expensive. This paper introduces Online Reward Selection and Policy Optimization (ORSO), a novel approach that frames shaping reward selection as an online model selection problem. ORSO employs principled exploration strategies to automatically identify promising shaping reward functions without human intervention, balancing exploration and exploitation with provable regret guarantees. We demonstrate ORSO's effectiveness across various continuous control tasks using the Isaac Gym simulator. Compared to traditional methods that fully evaluate each shaping reward function, ORSO significantly improves sample efficiency, reduces computational time, and consistently identifies high-quality reward functions that produce policies comparable to those generated by domain experts through hand-engineered rewards.

Effective spatio-temporal measurements of water surface elevation (water waves) in laboratory experiments are essential for scientific and engineering research. Existing techniques are often cumbersome, computationally heavy and generally suffer from limited wavenumber/frequency response. To address this challenge, we propose the Wave (from) Polarized Light Learning (WPLL), a learning based remote sensing method for laboratory implementation, capable of inferring surface elevation and slope maps in high resolution. The method uses the polarization properties of the light reflected from the water surface. The WPLL uses a deep neural network (DNN) model that approximates the water surface slopes from the polarized light intensities. Once trained on simple monochromatic wave trains, the WPLL is capable of producing high-resolution and accurate reconstruction of the 2D water surface slopes and elevation in a variety of irregular wave fields. The method's robustness is demonstrated by showcasing its high wavenumber/frequency response, its ability to reconstruct wave fields propagating in arbitrary angles relative to the camera optical axis, and its computational efficiency. This developed methodology is an accurate and cost-effective near-real time remote sensing tool for laboratory water surface waves measurements, setting the path for upscaling to open sea application for research, monitoring, and short-time forecasting.

Ensuring safe interactions in human-centric environments requires robots to understand and adhere to constraints recognized by humans as "common sense" (e.g., "moving a cup of water above a laptop is unsafe as the water may spill" or "rotating a cup of water is unsafe as it can lead to pouring its content"). Recent advances in computer vision and machine learning have enabled robots to acquire a semantic understanding of and reason about their operating environments. While extensive literature on safe robot decision-making exists, semantic understanding is rarely integrated into these formulations. In this work, we propose a semantic safety filter framework to certify robot inputs with respect to semantically defined constraints (e.g., unsafe spatial relationships, behaviours, and poses) and geometrically defined constraints (e.g., environment-collision and self-collision constraints). In our proposed approach, given perception inputs, we build a semantic map of the 3D environment and leverage the contextual reasoning capabilities of large language models to infer semantically unsafe conditions. These semantically unsafe conditions are then mapped to safe actions through a control barrier certification formulation. We evaluated our semantic safety filter approach in teleoperated tabletop manipulation tasks and pick-and-place tasks, demonstrating its effectiveness in incorporating semantic constraints to ensure safe robot operation beyond collision avoidance.

This research is part of a systematic study of scientific time series. In the last three years, hundreds of papers and over fifty new deep-learning models have been described for time series models. These mainly focus on the key aspect of time dependence, whereas in some scientific time series, the situation is more complex with multiple locations, each location having multiple observed and target time-dependent streams and multiple exogenous (known) properties that are either constant or time-dependent. Here, we analyze the hydrology time series using the CAMELS and Caravan global datasets on catchment rainfall and runoff. Together, these have up to 6 observed streams and up to 209 static parameters defined at each of about 8000 locations. This analysis is fully open source with a Jupyter Notebook running on Google Colab for both an LSTM-based analysis and the data engineering preprocessing. Our goal is to investigate the importance of exogenous data, which we look at using eight different choices on representative hydrology tasks. Increasing the exogenous information significantly improves the data representation, with the mean square error decreasing to 60% of its initial value in the largest dataset examined. We present the initial results of studies of other deep-learning neural network architectures where the approaches that can use the full observed and exogenous observations outperform less flexible methods, including Foundation models. Using the natural annual periodic exogenous time series produces the largest impact, but the static and other periodic exogenous streams are also important. Our analysis is intended to be valuable as an educational resource and benchmark.

Monte Carlo (MC) simulations, particularly using FLUKA, are essential for replicating real-world scenarios across scientific and engineering fields. Despite the robustness and versatility, FLUKA faces significant limitations in automation and integration with external post-processing tools, leading to workflows with a steep learning curve, which are time-consuming and prone to human errors. Traditional methods involving the use of shell and Python scripts, MATLAB, and Microsoft Excel require extensive manual intervention and lack flexibility, adding complexity to evolving scenarios. This study explores the potential of Large Language Models (LLMs) and AI agents to address these limitations. AI agents, integrate natural language processing with autonomous reasoning for decision-making and adaptive planning, making them ideal for automation. We introduce AutoFLUKA, an AI agent application developed using the LangChain Python Framework to automate typical MC simulation workflows in FLUKA. AutoFLUKA can modify FLUKA input files, execute simulations, and efficiently process results for visualization, significantly reducing human labor and error. Our case studies demonstrate that AutoFLUKA can handle both generalized and domain-specific cases, such as Microdosimetry, with an streamlined automated workflow, showcasing its scalability and flexibility. The study also highlights the potential of Retrieval Augmentation Generation (RAG) tools to act as virtual assistants for FLUKA, further improving user experience, time and efficiency. In conclusion, AutoFLUKA represents a significant advancement in automating MC simulation workflows, offering a robust solution to the inherent limitations. This innovation not only saves time and resources but also opens new paradigms for research and development in high energy physics, medical physics, nuclear engineering space and environmental science.

In the control problems of the PDE systems, observation is important to make the decision. However, the observation is generally sparse and missing in practice due to the limitation and fault of sensors. The above challenges cause observations with uncertain quantities and modalities. Therefore, how to leverage the uncertain observations as the states in control problems of the PDE systems has become a scientific problem. The dynamics of PDE systems rely on the initial conditions, boundary conditions, and PDE formula. Given the above three elements, PINNs can be used to solve the PDE systems. In this work, we discover that the neural network can also be used to identify and represent the PDE systems using PDE loss and sparse data loss. Inspired by the above discovery, we propose a Physics-Informed Representation (PIR) algorithm for multimodal policies in PDE systems' control. It leverages PDE loss to fit the neural network and data loss calculated on the observations with random quantities and modalities to propagate the information of initial conditions and boundary conditions into the inputs. The inputs can be the learnable parameters or the output of the encoders. Then, under the environments of the PDE systems, such inputs are the representation of the current state. In our experiments, the PIR illustrates the superior consistency with the features of the ground truth compared with baselines, even when there are missing modalities. Furthermore, PIR has been successfully applied in the downstream control tasks where the robot leverages the learned state by PIR faster and more accurately, passing through the complex vortex street from a random starting location to reach a random target.

Topic modeling is a powerful technique for uncovering hidden themes within a collection of documents. However, the effectiveness of traditional topic models often relies on sufficient word co-occurrence, which is lacking in short texts. Therefore, existing approaches, whether probabilistic or neural, frequently struggle to extract meaningful patterns from such data, resulting in incoherent topics. To address this challenge, we propose a novel approach that leverages large language models (LLMs) to extend short texts into more detailed sequences before applying topic modeling. To further improve the efficiency and solve the problem of semantic inconsistency from LLM-generated texts, we propose to use prefix tuning to train a smaller language model coupled with a variational autoencoder for short-text topic modeling. Our method significantly improves short-text topic modeling performance, as demonstrated by extensive experiments on real-world datasets with extreme data sparsity, outperforming current state-of-the-art topic models.

This paper proposes a data-driven solution for Volt-VAR control problem in active distribution system. As distribution system models are always inaccurate and incomplete, it is quite difficult to solve the problem. To handle with this dilemma, this paper formulates the Volt-VAR control problem as a constrained Markov decision process (CMDP). By synergistically combining the augmented Lagrangian method and soft actor critic algorithm, a novel safe off-policy reinforcement learning (RL) approach is proposed in this paper to solve the CMDP. The actor network is updated in a policy gradient manner with the Lagrangian value function. A double-critics network is adopted to synchronously estimate the action-value function to avoid overestimation bias. The proposed algorithm does not require strong convexity guarantee of examined problems and is sample efficient. A two-stage strategy is adopted for offline training and online execution, so the accurate distribution system model is no longer needed. To achieve scalability, a centralized training distributed execution strategy is adopted for a multi-agent framework, which enables a decentralized Volt-VAR control for large-scale distribution system. Comprehensive numerical experiments with real-world electricity data demonstrate that our proposed algorithm can achieve high solution optimality and constraints compliance.

Accurate forecasting of electrical demand is essential for maintaining a stable and reliable power grid, optimizing the allocation of energy resources, and promoting efficient energy consumption practices. This study investigates the effectiveness of five hyperparameter optimization (HPO) algorithms -- Random Search, Covariance Matrix Adaptation Evolution Strategy (CMA--ES), Bayesian Optimization, Partial Swarm Optimization (PSO), and Nevergrad Optimizer (NGOpt) across univariate and multivariate Short-Term Load Forecasting (STLF) tasks. Using the Panama Electricity dataset (n=48,049), we evaluate HPO algorithms' performances on a surrogate forecasting algorithm, XGBoost, in terms of accuracy (i.e., MAPE, $R^2$) and runtime. Performance plots visualize these metrics across varying sample sizes from 1,000 to 20,000, and Kruskal--Wallis tests assess the statistical significance of the performance differences. Results reveal significant runtime advantages for HPO algorithms over Random Search. In univariate models, Bayesian optimization exhibited the lowest accuracy among the tested methods. This study provides valuable insights for optimizing XGBoost in the STLF context and identifies areas for future research.

The substantial effect of air pollution on cardiovascular disease and mortality burdens is well-established. Emissions-reducing interventions on coal-fired power plants -- a major source of hazardous air pollution -- have proven to be an effective, but costly, strategy for reducing pollution-related health burdens. Targeting the power plants that achieve maximum health benefits while satisfying realistic cost constraints is challenging. The primary difficulty lies in quantifying the health benefits of intervening at particular plants. This is further complicated because interventions are applied on power plants, while health impacts occur in potentially distant communities, a setting known as bipartite network interference (BNI). In this paper, we introduce novel policy learning methods based on Q- and A-Learning to determine the optimal policy under arbitrary BNI. We derive asymptotic properties and demonstrate finite sample efficacy in simulations. We apply our novel methods to a comprehensive dataset of Medicare claims, power plant data, and pollution transport networks. Our goal is to determine the optimal strategy for installing power plant scrubbers to minimize ischemic heart disease (IHD) hospitalizations under various cost constraints. We find that annual IHD hospitalization rates could be reduced in a range from 20.66-44.51 per 10,000 person-years through optimal policies under different cost constraints.