Industry
AssayMatch: Learning to Select Data for Molecular Activity Models
Fan, Vincent, Barzilay, Regina
The performance of machine learning models in drug discovery is highly dependent on the quality and consistency of the underlying training data. Due to limitations in dataset sizes, many models are trained by aggregating bioactivity data from diverse sources, including public databases such as ChEMBL. However, this approach often introduces significant noise due to variability in experimental protocols. We introduce AssayMatch, a framework for data selection that builds smaller, more homogenous training sets attuned to the test set of interest. AssayMatch leverages data attribution methods to quantify the contribution of each training assay to model performance. These attribution scores are used to finetune language embeddings of text-based assay descriptions to capture not just semantic similarity, but also the compatibility between assays. Unlike existing data attribution methods, our approach enables data selection for a test set with unknown labels, mirroring real-world drug discovery campaigns where the activities of candidate molecules are not known in advance. At test time, embeddings finetuned with AssayMatch are used to rank all available training data. We demonstrate that models trained on data selected by AssayMatch are able to surpass the performance of the model trained on the complete dataset, highlighting its ability to effectively filter out harmful or noisy experiments. We perform experiments on two common machine learning architectures and see increased prediction capability over a strong language-only baseline for 9/12 model-target pairs. AssayMatch provides a data-driven mechanism to curate higher-quality datasets, reducing noise from incompatible experiments and improving the predictive power and data efficiency of models for drug discovery. AssayMatch is available at https://github.com/Ozymandias314/AssayMatch.
SpectralTrain: A Universal Framework for Hyperspectral Image Classification
Zhou, Meihua, Yu, Liping, Cai, Jiawei, Fung, Wai Kin, Hu, Ruiguo, Zhao, Jiarui, Liu, Wenzhuo, Wan, Nan
Hyperspectral image (HSI) classification typically involves large-scale data and computationally intensive training, which limits the practical deployment of deep learning models in real-world remote sensing tasks. This study introduces SpectralTrain, a universal, architecture-agnostic training framework that enhances learning efficiency by integrating curriculum learning (CL) with principal component analysis (PCA)-based spectral downsampling. By gradually introducing spectral complexity while preserving essential information, SpectralTrain enables efficient learning of spectral -- spatial patterns at significantly reduced computational costs. The framework is independent of specific architectures, optimizers, or loss functions and is compatible with both classical and state-of-the-art (SOTA) models. Extensive experiments on three benchmark datasets -- Indian Pines, Salinas-A, and the newly introduced CloudPatch-7 -- demonstrate strong generalization across spatial scales, spectral characteristics, and application domains. The results indicate consistent reductions in training time by 2-7x speedups with small-to-moderate accuracy deltas depending on backbone. Its application to cloud classification further reveals potential in climate-related remote sensing, emphasizing training strategy optimization as an effective complement to architectural design in HSI models. Code is available at https://github.com/mh-zhou/SpectralTrain.
A Hybrid Proactive And Predictive Framework For Edge Cloud Resource Management
Kumar, Hrikshesh, Garg, Anika, Gupta, Anshul, Agarwal, Yashika
Old cloud edge workload resource management is too reactive. The problem with relying on static thresholds is that we are either overspending for more resources than needed or have reduced performance because of their lack. This is why we work on proactive solutions. A framework developed for it stops reacting to the problems but starts expecting them. We design a hybrid architecture, combining two powerful tools: the CNN LSTM model for time series forecasting and an orchestrator based on multi agent Deep Reinforcement Learning In fact the novelty is in how we combine them as we embed the predictive forecast from the CNN LSTM directly into the DRL agent state space. That is what makes the AI manager smarter it sees the future, which allows it to make better decisions about a long term plan for where to run tasks That means finding that sweet spot between how much money is saved while keeping the system healthy and apps fast for users That is we have given it eyes in order to see down the road so that it does not have to lurch from one problem to another it finds a smooth path forward Our tests show our system easily beats the old methods It is great at solving tough problems like making complex decisions and juggling multiple goals at once like being cheap fast and reliable
Early science acceleration experiments with GPT-5
Bubeck, Sรฉbastien, Coester, Christian, Eldan, Ronen, Gowers, Timothy, Lee, Yin Tat, Lupsasca, Alexandru, Sawhney, Mehtaab, Scherrer, Robert, Sellke, Mark, Spears, Brian K., Unutmaz, Derya, Weil, Kevin, Yin, Steven, Zhivotovskiy, Nikita
AI models like GPT-5 are an increasingly valuable tool for scientists, but many remain unaware of the capabilities of frontier AI. We present a collection of short case studies in which GPT-5 produced new, concrete steps in ongoing research across mathematics, physics, astronomy, computer science, biology, and materials science. In these examples, the authors highlight how AI accelerated their work, and where it fell short; where expert time was saved, and where human input was still key. We document the interactions of the human authors with GPT-5, as guiding examples of fruitful collaboration with AI. Of note, this paper includes four new results in mathematics (carefully verified by the human authors), underscoring how GPT-5 can help human mathematicians settle previously unsolved problems. These contributions are modest in scope but profound in implication, given the rate at which frontier AI is progressing.
Gauge-Equivariant Graph Networks via Self-Interference Cancellation
Choi, Yoonhyuk, Kim, Chong-Kwon
Graph Neural Networks (GNNs) excel on homophilous graphs but often fail under heterophily due to self-reinforcing and phase-inconsistent signals. We propose a Gauge-Equivariant Graph Network with Self-Interference Cancellation (GESC), which replaces additive aggregation with a projection-based interference mechanism. Unlike prior magnetic or gauge-equivariant GNNs that typically focus on phase handling in spectral filtering while largely relying on scalar weighting, GESC introduces a $\mathrm{U}(1)$ phase connection followed by a rank-1 projection that attenuates self-parallel components before attention. A sign- and phase-aware gate further regulates neighbor influence, attenuating components aligned with current node states and acting as a local notch on low-frequency modes. Across diverse graph benchmarks, our method consistently outperforms recent state-of-the-art models while offering a unified, interference-aware view of message passing. Our code is available at \href{here}{https://anonymous.4open.science/r/GESC-1B22}.
Artificial Intelligence and Accounting Research: A Framework and Agenda
Stratopoulos, Theophanis C., Wang, Victor Xiaoqi
Recent advances in artificial intelligence, particularly generative AI (GenAI) and large language models (LLMs), are fundamentally transforming accounting research, creating both opportunities and competitive threats for scholars. This paper proposes a framework that classifies AI-accounting research along two dimensions: research focus (accounting-centric versus AI-centric) and methodological approach (AI-based versus traditional methods). We apply this framework to papers from the IJAIS special issue and recent AI-accounting research published in leading accounting journals to map existing studies and identify research opportunities. Using this same framework, we analyze how accounting researchers can leverage their expertise through strategic positioning and collaboration, revealing where accounting scholars' strengths create the most value. We further examine how GenAI and LLMs transform the research process itself, comparing the capabilities of human researchers and AI agents across the entire research workflow. This analysis reveals that while GenAI democratizes certain research capabilities, it simultaneously intensifies competition by raising expectations for higher-order contributions where human judgment, creativity, and theoretical depth remain valuable. These shifts call for reforming doctoral education to cultivate comparative advantages while building AI fluency.
Semantic Glitch: Agency and Artistry in an Autonomous Pixel Cloud
Zhang, Qing, Huang, Jing, Xu, Mingyang, Rekimoto, Jun
While mainstream robotics pursues metric precision and flawless performance, this paper explores the creative potential of a deliberately "lo-fi" approach. We present the "Semantic Glitch," a soft flying robotic art installation whose physical form, a 3D pixel style cloud, is a "physical glitch" derived from digital archaeology. We detail a novel autonomous pipeline that rejects conventional sensors like LiDAR and SLAM, relying solely on the qualitative, semantic understanding of a Multimodal Large Language Model to navigate. By authoring a bio-inspired personality for the robot through a natural language prompt, we create a "narrative mind" that complements the "weak," historically, loaded body. Our analysis begins with a 13-minute autonomous flight log, and a follow-up study statistically validates the framework's robustness for authoring quantifiably distinct personas. The combined analysis reveals emergent behaviors, from landmark-based navigation to a compelling "plan to execution" gap, and a character whose unpredictable, plausible behavior stems from a lack of precise proprioception. This demonstrates a lo-fi framework for creating imperfect companions whose success is measured in character over efficiency.
An Aligned Constraint Programming Model For Serial Batch Scheduling With Minimum Batch Size
Huertas, Jorge A., Van Hentenryck, Pascal
Abstract--In serial batch (s-batch) scheduling, jobs from similar families are grouped into batches and processed sequentially to avoid repetitive setups that are required when processing consecutive jobs of different families. Despite its large success in scheduling, only three Constraint Programming (CP) models have been proposed for this problem considering minimum batch sizes, which is a common requirement in many practical settings, including the ion implantation area in semiconductor manufacturing. These existing CP models rely on a predefined virtual set of possible batches that suffers from the curse of dimensionality and adds complexity to the problem. This paper proposes a novel CP model that does not rely on this virtual set. Instead, it uses key alignment parameters that allow it to reason directly on the sequences of same-family jobs scheduled on the machines, resulting in a more compact formulation. This new model is further improved by exploiting the problem's structure with tailored search phases and strengthened inference levels of the constraint propagators. The extensive computational experiments on nearly five thousand instances compare the proposed models against existing methods in the literature, including mixed-integer programming formulations, tabu search meta-heuristics, and CP approaches. The results demonstrate the superiority of the proposed models on small-to-medium instances with up to 100 jobs, and their ability to find solutions up to 25% better than the ones produces by existing methods on large-scale instances with up to 500 jobs, 10 families, and 10 machines. In the current and highly competitive landscape of the manufacturing industry, companies are under growing pressure to minimize production costs and reduce cycle times. A crucial approach to achieving these goals and boosting production efficiency is processing multiple similar jobs in groups called batches [1]. Two types of batching can be distinguished in the scheduling literature, depending on how the jobs are processed inside their batch: (i) parallel batching (p-batch), where jobs inside a batch are processed in parallel at the same time [2]; and (ii) serial batching (s-batch), where jobs inside a batch are processed sequentially, one after the other [3]. The benefits of p-batching in the manufacturing industry are straightforward due to the parallelized processing of the jobs inside a batch. In contrast, the benefits of s-batching usually come from grouping jobs that require similar machine configurations to avoid repetitive setups [4].
Agent0: Unleashing Self-Evolving Agents from Zero Data via Tool-Integrated Reasoning
Xia, Peng, Zeng, Kaide, Liu, Jiaqi, Qin, Can, Wu, Fang, Zhou, Yiyang, Xiong, Caiming, Yao, Huaxiu
Large Language Model (LLM) Agents, often trained with Reinforcement Learning (RL), are constrained by a dependency on human-curated data, limiting scalability and tethering AI to human knowledge. Existing self-evolution frameworks offer an alternative but are typically restricted by the model's inherent capabilities and single-round interactions, hindering the development of complex curricula involving tool use or dynamic reasoning. We introduce Agent0, a fully autonomous framework that evolves high-performing agents without external data through multi-step co-evolution and seamless tool integration. Agent0 establishes a symbiotic competition between two agents initialized from the same base LLM: a curriculum agent that proposes increasingly challenging frontier tasks, and an executor agent that learns to solve them. We integrate external tools to enhance the executor's problem-solving capacity; this improvement, in turn, pressures the curriculum agent to construct more complex, tool-aware tasks. Through this iterative process, Agent0 establishes a self-reinforcing cycle that continuously produces high-quality curricula. Empirically, Agent0 substantially boosts reasoning capabilities, improving the Qwen3-8B-Base model by 18% on mathematical reasoning and 24% on general reasoning benchmarks. Code is available at https://github.com/aiming-lab/Agent0.
HGCN2SP: Hierarchical Graph Convolutional Network for Two-Stage Stochastic Programming
Wu, Yang, Zhang, Yifan, Liang, Zhenxing, Cheng, Jian
Two-stage Stochastic Programming (2SP) is a standard framework for modeling decision-making problems under uncertainty. While numerous methods exist, solving such problems with many scenarios remains challenging. Selecting representative scenarios is a practical method for accelerating solutions. However, current approaches typically rely on clustering or Monte Carlo sampling, failing to integrate scenario information deeply and overlooking the significant impact of the scenario order on solving time. To address these issues, we develop HGCN2SP, a novel model with a hierarchical graph designed for 2SP problems, encoding each scenario and modeling their relationships hierarchically. The model is trained in a reinforcement learning paradigm to utilize the feedback of the solver. The policy network is equipped with a hierarchical graph convolutional network for feature encoding and an attention-based decoder for scenario selection in proper order. Evaluation of two classic 2SP problems demonstrates that HGCN2SP provides high-quality decisions in a short computational time. Furthermore, HGCN2SP exhibits remarkable generalization capabilities in handling large-scale instances, even with a substantial number of variables or scenarios that were unseen during the training phase.