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Recent progress in Large Language Models (LLMs) has drawn attention to their potential for accelerating drug discovery. However, a central problem remains: translating theoretical ideas into robust implementations in the highly specialized…

Machine Learning · Computer Science 2025-03-06 Sizhe Liu , Yizhou Lu , Siyu Chen , Xiyang Hu , Jieyu Zhao , Yingzhou Lu , Yue Zhao

Language model (LM)-based agents have demonstrated promising capabilities in automating complex tasks from natural language instructions, yet they continue to struggle with long-horizon planning and reasoning. To address this, we propose an…

Artificial Intelligence · Computer Science 2026-05-05 Wenyi Wu , Sibo Zhu , Kun Zhou , Biwei Huang

Feature engineering has demonstrated substantial utility for many machine learning workflows, such as in the small data regime or when distribution shifts are severe. Thus automating this capability can relieve much manual effort and…

Machine Learning · Computer Science 2024-06-07 Yihe Dong , Sercan Arik , Nathanael Yoder , Tomas Pfister

Maintaining high data quality is crucial for reliable data analysis and machine learning (ML). However, existing data quality management tools often lack automation, interactivity, and integration with ML workflows. This demonstration paper…

Databases · Computer Science 2025-01-29 Mohamed Abdelaal , Samuel Lokadjaja , Arne Kreuz , Harald Schöning

In this technical report, we present SWE-Master, an open-source and fully reproducible post-training framework for building effective software engineering agents. SWE-Master systematically explores the complete agent development pipeline,…

AI agents are increasingly used to solve complex, multi-step tasks, but existing multi-agent frameworks remain brittle as workflows grow in scale and depth. Small errors at intermediate stages can propagate through agent interactions, while…

Artificial Intelligence · Computer Science 2026-05-26 Andy Xu , Yu-Wing Tai

Mobile GUI agents powered by large foundation models enable autonomous task execution, but frequent updates altering UI appearance and reorganizing workflows cause agents trained on historical data to fail. Despite surface changes,…

Artificial Intelligence · Computer Science 2026-02-03 Libo Sun , Jiwen Zhang , Siyuan Wang , Zhongyu Wei

The quality of training data has a huge impact on the efficiency, accuracy and complexity of machine learning tasks. Various tools and techniques are available that assess data quality with respect to general cleaning and profiling checks.…

Imitation learning field requires expert data to train agents in a task. Most often, this learning approach suffers from the absence of available data, which results in techniques being tested on its dataset. Creating datasets is a…

Machine Learning · Computer Science 2024-03-04 Nathan Gavenski , Michael Luck , Odinaldo Rodrigues

Over the past decade, data science and machine learning has grown from a mysterious art form to a staple tool across a variety of fields in academia, business, and government. In this paper, we introduce the concept of tree-based pipeline…

Machine Learning · Computer Science 2016-02-01 Randal S. Olson , Ryan J. Urbanowicz , Peter C. Andrews , Nicole A. Lavender , La Creis Kidd , Jason H. Moore

Existing machine learning engineering (MLE) agents struggle to iteratively optimize their implemented algorithms for effectiveness. To address this, we introduce MLE-Ideator, a dual-agent framework that separates ideation from…

Computation and Language · Computer Science 2026-01-27 Yunxiang Zhang , Kang Zhou , Zhichao Xu , Kiran Ramnath , Yun Zhou , Sangmin Woo , Haibo Ding , Lin Lee Cheong

Large Language Models (LLMs) can be fine-tuned on domain-specific data to enhance their performance in specialized fields. However, such data often contains numerous low-quality samples, necessitating effective data processing (DP). In…

Machine Learning · Computer Science 2026-05-08 Wei Huang , Anda Cheng , Yinggui Wang , Lei Wang , Tao Wei

Automating machine learning has achieved remarkable technological developments in recent years, and building an automated machine learning pipeline is now an essential task. The model ensemble is the technique of combining multiple models…

Machine Learning · Computer Science 2022-07-21 Yunpu Zhao , Rui Zhang , Xiaqing Li

Automated feature engineering plays a critical role in improving predictive model performance for tabular learning tasks. Traditional automated feature engineering methods are limited by their reliance on pre-defined transformations within…

Machine Learning · Computer Science 2026-05-12 Nikhil Abhyankar , Parshin Shojaee , Chandan K. Reddy

Data science (DS) projects often follow a lifecycle that consists of laborious tasks for data scientists and domain experts (e.g., data exploration, model training, etc.). Only till recently, machine learning(ML) researchers have developed…

Human-Computer Interaction · Computer Science 2021-01-15 Dakuo Wang , Josh Andres , Justin Weisz , Erick Oduor , Casey Dugan

A recent take towards Federated Analytics (FA), which allows analytical insights of distributed datasets, reuses the Federated Learning (FL) infrastructure to evaluate the summary of model performances across the training devices. However,…

Machine Learning · Computer Science 2021-06-01 Shashi Raj Pandey , Minh N. H. Nguyen , Tri Nguyen Dang , Nguyen H. Tran , Kyi Thar , Zhu Han , Choong Seon Hong

Addressing intricate real-world problems necessitates in-depth information seeking and multi-step reasoning. Recent progress in agentic systems, exemplified by Deep Research, underscores the potential for autonomous multi-step research. In…

Computation and Language · Computer Science 2025-08-12 Jialong Wu , Baixuan Li , Runnan Fang , Wenbiao Yin , Liwen Zhang , Zhengwei Tao , Dingchu Zhang , Zekun Xi , Gang Fu , Yong Jiang , Pengjun Xie , Fei Huang , Jingren Zhou

AutoModel is an agent based architecture for the full lifecycle of industrial recommender systems. Instead of a fixed recall and ranking pipeline, AutoModel organizes recommendation as a set of interacting evolution agents with long term…

Information Retrieval · Computer Science 2026-04-10 Hao Zhang , Jinxin Hu , Hao Deng , Lingyu Mu , Shizhun Wang , Yu Zhang , Xiaoyi Zeng

Data transfers are essential in today's computing systems as latency and complex memory access patterns are increasingly challenging to manage. Direct memory access engines (DMAEs) are critically needed to transfer data independently of the…

When combining Large Language Models (LLMs) with autonomous agents, used in network monitoring and decision-making systems, this will create serious security issues. In this research, the MAESTRO framework consisting of the seven layers…

Cryptography and Security · Computer Science 2025-08-15 Pallavi Zambare , Venkata Nikhil Thanikella , Ying Liu
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