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This position paper argues that optimization problem solving can transition from expert-dependent to evolutionary agentic workflows. Traditional optimization practices rely on human specialists for problem formulation, algorithm selection,…

Optimization and Control · Mathematics 2025-05-08 Wenhao Li , Bo Jin , Mingyi Hong , Changhong Lu , Xiangfeng Wang

Agentic AI is rapidly transitioning from research prototypes to enterprise deployments, where requirements extend to meet the software quality attributes of reliability, scalability, and observability beyond plausible text generation. We…

Artificial Intelligence · Computer Science 2026-03-05 Alfio Massimiliano Gliozzo , Junkyu Lee , Nahuel Defosse

AI agents are emerging as a dominant workload in a wide range of applications, promising to be the vehicle that delivers the promised benefits of AI to enterprises and consumers. Unlike conventional software or static inference, agentic…

Machine Learning · Computer Science 2025-07-29 Zain Asgar , Michelle Nguyen , Sachin Katti

Large Language Models (LLMs) are evolving into autonomous agents, yet current "frameless" development--relying on ambiguous natural language without engineering blueprints--leads to critical risks such as scope creep and open-loop failures.…

Artificial Intelligence · Computer Science 2026-02-24 Chanjin Park

AI agents have recently shown significant promise in software engineering. Much public attention has been transfixed on the topic of code generation from Large Language Models (LLMs) via a prompt. However, software engineering is much more…

Software Engineering · Computer Science 2025-09-23 Abhik Roychoudhury

Agentic artificial intelligence (AI) is a natural fit for Internet of Things (IoT) and edge systems, but edge deployments are often constrained to models around 8 billion parameters or smaller. An important question is: How much…

Artificial Intelligence · Computer Science 2026-05-12 Shiqiang Wang , Herbert Woisetschläger

Integrating symbolic constraints into deep learning models could make them more robust, interpretable, and data-efficient. Still, it remains a time-consuming and challenging task. Existing frameworks like DomiKnowS help this integration by…

Artificial Intelligence · Computer Science 2026-01-05 Aliakbar Nafar , Chetan Chigurupati , Danial Kamali , Hamid Karimian , Parisa Kordjamshidi

Agentic tasks, which require multi-step problem solving with autonomy, tool use, and adaptive reasoning, are becoming increasingly central to the advancement of NLP and AI. However, existing instruction data lacks tool interaction, and…

The emergence of large language models has catalyzed two distinct yet interconnected paradigms in artificial intelligence: standalone AI Agents and collaborative Agentic AI ecosystems. This comprehensive study establishes a definitive…

Artificial Intelligence · Computer Science 2025-06-17 Prashik Buddhaghosh Bansod

Algorithmic differentiation (AD) allows exact computation of derivatives given only an implementation of an objective function. Although many AD tools are available, a proper and efficient implementation of AD methods is not…

Mathematical Software · Computer Science 2018-07-27 Filip Šrajer , Zuzana Kukelova , Andrew Fitzgibbon

Data science plays a critical role in transforming complex data into actionable insights across numerous domains. Recent developments in large language models (LLMs) have significantly automated data science workflows, but a fundamental…

Large Language Models (LLMs) are increasingly deployed within agentic systems - collections of interacting, LLM-powered agents that execute complex, adaptive workflows using memory, tools, and dynamic planning. While enabling powerful new…

Artificial Intelligence · Computer Science 2025-11-21 Dany Moshkovich , Sergey Zeltyn

Agentic AI represents a major shift in how autonomous systems reason, plan, and execute multi-step tasks through the coordination of Large Language Models (LLMs), Vision Language Models (VLMs), tools, and external services. While these…

The rapid evolution of agentic AI marks a new phase in artificial intelligence, where Large Language Models (LLMs) no longer merely respond but act, reason, and adapt. This survey traces the paradigm shift in building agentic AI: from…

Artificial Intelligence · Computer Science 2025-10-28 Jitao Sang , Jinlin Xiao , Jiarun Han , Jilin Chen , Xiaoyi Chen , Shuyu Wei , Yongjie Sun , Yuhang Wang

Scientific workflows in computational chemistry and materials science typically involve multiple interdependent steps, such as model preparation, system construction, simulation execution, and data analysis, that researchers have refined…

The field of Artificial Intelligence is undergoing a transition from Generative AI -- probabilistic generation of text and images -- to Agentic AI, in which autonomous systems execute actions within external environments on behalf of users.…

Artificial Intelligence · Computer Science 2026-03-02 Sheng Cao , Zhao Chang , Chang Li , Hannan Li , Liyao Fu , Ji Tang

Building deployment-ready LLM agents requires complex orchestration of tools, data sources, and control flow logic, yet existing systems tightly couple agent logic to specific programming languages and deployment models. We present a…

Software Engineering · Computer Science 2025-12-24 Ivan Daunis

The emergence of Agentic AI systems has outpaced the architectural thinking required to operate them effectively. These agents differ fundamentally from traditional software: their behavior is not fixed at deployment but continuously shaped…

Software Engineering · Computer Science 2026-01-13 Shaunak Biswas , Hiya Bhatt , Karthik Vaidhyanathan

We present a two-stage pipeline for AI-assisted improvement of published algorithm implementations. In the first stage, a large language model with research capabilities identifies recently published algorithms satisfying explicit…

Software Engineering · Computer Science 2026-04-16 Worasait Suwannik

Anomaly detection (AD) is essential in areas such as fraud detection, network monitoring, and scientific research. However, the diversity of data modalities and the increasing number of specialized AD libraries pose challenges for…

Computation and Language · Computer Science 2025-05-20 Tiankai Yang , Junjun Liu , Wingchun Siu , Jiahang Wang , Zhuangzhuang Qian , Chanjuan Song , Cheng Cheng , Xiyang Hu , Yue Zhao