Energy
Hierarchical Graph Networks for Accurate Weather Forecasting via Lightweight Training
Bailie, Thomas, Mukkavilli, S. Karthik, Vetrova, Varvara, Koh, Yun Sing
Climate events arise from intricate, multivariate dynamics governed by global-scale drivers, profoundly impacting food, energy, and infrastructure. Yet, accurate weather prediction remains elusive due to physical processes unfolding across diverse spatio-temporal scales, which fixed-resolution methods cannot capture. Hierarchical Graph Neural Networks (HGNNs) offer a multiscale representation, but nonlinear downward mappings often erase global trends, weakening the integration of physics into forecasts. We introduce HiFlowCast and its ensemble variant HiAntFlow, HGNNs that embed physics within a multiscale prediction framework. Two innovations underpin their design: a Latent-Memory-Retention mechanism that preserves global trends during downward traversal, and a Latent-to-Physics branch that integrates PDE solution fields across diverse scales. Our Flow models cut errors by over 5% at 13-day lead times and by 5-8% under 1st and 99th quantile extremes, improving reliability for rare events. Leveraging pretrained model weights, they converge within a single epoch, reducing training cost and their carbon footprint. Such efficiency is vital as the growing scale of machine learning challenges sustainability and limits research accessibility. Code and model weights are in the supplementary materials.
Listen up: The Popular Science 'Ask Us Anything' podcast is back
Science Announcements Listen up: The Popular Science'Ask Us Anything' podcast is back Breakthroughs, discoveries, and DIY tips sent every weekday. Why do we have toenails? How do airplane toilets actually work? For more than 150 years, has answered your questions--from the serious to the outlandish. Based on our wildly popular written series of the same name, the audio version features host Sarah Durn and the editors discussing everything from goose bumps to human composting.
Four thoughts from Bill Gates on climate tech
Why he thinks near-term targets can be a distraction, and what technologies he expects to power our future grid. Bill Gates doesn't shy away or pretend modesty when it comes to his stature in the climate world today. "Well, who's the biggest funder of climate innovation companies?" he asked a handful of journalists at a media roundtable event last week. "If there's someone else, I've never met them." The former Microsoft CEO has spent the last decade investing in climate technology through Breakthrough Energy, which he founded in 2015. Ahead of the UN climate meetings kicking off next week, Gates published a memo outlining what he thinks activists and negotiators should focus on and how he's thinking about the state of climate tech right now.
Development of Implicit-Explicit Control Based Amphibious Centipede-Type Robot and Evaluation of its Mobile Performance
Tsunoda, Yusuke, Yamamoto, Seiya, Ito, Kazuki, Xiao, Runze, Naniwa, Keisuke, Osuka, Koichi
Multi-legged mobile robots possess high mobility performance in rough terrain environments, stemming from their high postural stability, joint flexibility, and the redundancy provided by multiple legs. In prior research on navigating between different environments such as land and water, the primary strategy employed involves switching to a controller that generates an appropriate gait for the new environment upon entering it. However, designing appropriate gaits for each complex and diverse environment and accurately determining controller switching for each environment is challenging. Therefore, this research develops a centipede-type mobile robot that navigates both aquatic and terrestrial environments with a simple, unified control scheme, based on the implicit-explicit control philosophy and by ingeniously designing the robot's body structure. In this research, we developed the robot featuring flexible joints and left and right legs on each body segment and focused on the leg structure which has extensive contact with the environment. This paper evaluates the locomotion performance on land and water using the three developed leg structures, using the robot's leg slip rate and actuator energy consumption as evaluation metrics. The experimental results confirmed the existence of an appropriate leg structure capable of navigating both aquatic and terrestrial environments under identical control.
Learning-Augmented Online Bidding in Stochastic Settings
Angelopoulos, Spyros, Simon, Bertrand
Online bidding is a classic optimization problem, with several applications in online decision-making, the design of interruptible systems, and the analysis of approximation algorithms. In this work, we study online bidding under learning-augmented settings that incorporate stochasticity, in either the prediction oracle or the algorithm itself. In the first part, we study bidding under distributional predictions, and find Pareto-optimal algorithms that offer the best-possible tradeoff between the consistency and the robustness of the algorithm. In the second part, we study the power and limitations of randomized bidding algorithms, by presenting upper and lower bounds on the consistency/robustness tradeoffs. Previous works focused predominantly on oracles that do not leverage stochastic information on the quality of the prediction, and deterministic algorithms.
Position: Biology is the Challenge Physics-Informed ML Needs to Evolve
Physics-Informed Machine Learning (PIML) has successfully integrated mechanistic understanding into machine learning, particularly in domains governed by well-known physical laws. This success has motivated efforts to apply PIML to biology, a field rich in dynamical systems but shaped by different constraints. Biological modeling, however, presents unique challenges: multi-faceted and uncertain prior knowledge, heterogeneous and noisy data, partial observability, and complex, high-dimensional networks. In this position paper, we argue that these challenges should not be seen as obstacles to PIML, but as catalysts for its evolution. We propose Biology-Informed Machine Learning (BIML): a principled extension of PIML that retains its structural grounding while adapting to the practical realities of biology. Rather than replacing PIML, BIML retools its methods to operate under softer, probabilistic forms of prior knowledge. We outline four foundational pillars as a roadmap for this transition: uncertainty quantification, contextualization, constrained latent structure inference, and scalability. Foundation Models and Large Language Models will be key enablers, bridging human expertise with computational modeling. We conclude with concrete recommendations to build the BIML ecosystem and channel PIML-inspired innovation toward challenges of high scientific and societal relevance.
Artificial Intelligence for Direct Prediction of Molecular Dynamics Across Chemical Space
Molecular dynamics (MD) is a powerful tool for exploring the behavior of atomistic systems, but its reliance on sequential numerical integration limits simulation efficiency. We present a novel neural network architecture, MDtrajNet, and a pre-trained foundational model, MDtrajNet-1, that directly generates MD trajectories across chemical space, bypassing force calculations and integration. This approach accelerates simulations by up to two orders of magnitude compared to traditional MD, even those enhanced by machine-learning interatomic potentials. MDtrajNet combines equivariant neural networks with a transformer-based architecture to achieve strong accuracy and transferability in predicting long-time trajectories. Remarkably, the errors of the trajectories generated by MDtrajNet-1 for various known and unseen molecular systems are close to those of the conventional ab initio MD. The architecture's flexible design supports diverse application scenarios, including different statistical ensembles, boundary conditions, and interaction types. By overcoming the intrinsic speed barrier of conventional MD, MDtrajNet opens new frontiers in efficient and scalable atomistic simulations.
Plexus: Taming Billion-edge Graphs with 3D Parallel Full-graph GNN Training
Ranjan, Aditya K., Singh, Siddharth, Wei, Cunyang, Bhatele, Abhinav
Graph neural networks (GNNs) leverage the connectivity and structure of real-world graphs to learn intricate properties and relationships between nodes. Many real-world graphs exceed the memory capacity of a GPU due to their sheer size, and training GNNs on such graphs requires techniques such as mini-batch sampling to scale. The alternative approach of distributed full-graph training suffers from high communication overheads and load imbalance due to the irregular structure of graphs. We propose a three-dimensional (3D) parallel approach for full-graph training that tackles these issues and scales to billion-edge graphs. In addition, we introduce optimizations such as a double permutation scheme for load balancing, and a performance model to predict the optimal 3D configuration of our parallel implementation -- Plexus. We evaluate Plexus on six different graph datasets and show scaling results on up to 2048 GPUs of Perlmutter, and 1024 GPUs of Frontier. Plexus achieves unprecedented speedups of 2.3-12.5x over prior state of the art, and a reduction in time-to-solution by 5.2-8.7x on Perlmutter and 7.0-54.2x on Frontier.
Collision avoidance and path finding in a robotic mobile fulfillment system using multi-objective meta-heuristics
The rapid growth of e-commerce in recent years has significantly transformed people's shopping habits [1]. Consumers increasingly favor online shopping over in-person purchases, leading to a substantial impact on product logistics, which plays a crucial role in customer satisfaction. In addition to product quality and other factors, the timely delivery of orders has become a key determinant of customer satisfaction. Picking and replenishment tasks are responsible for 65% of operating costs [2]. In a conventional manual order picking system, often referred to as a picker-to-parts system, pickers dedicate 70% of their working time to searching for items and traveling within the facility [3, 4].