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Lead optimization in drug discovery requires efficiently navigating vast chemical space through iterative cycles to enhance molecular properties while preserving structural similarity to the original lead compound. Despite recent advances,…

Machine Learning · Computer Science 2025-09-29 Ziqing Wang , Yibo Wen , William Pattie , Xiao Luo , Weimin Wu , Jerry Yao-Chieh Hu , Abhishek Pandey , Han Liu , Kaize Ding

This work reframes the Text-to-SQL task as a pathway for teaching large language models (LLMs) to reason over and manipulate tabular data--moving beyond the traditional focus on query generation. We propose a two-stage framework that…

Computation and Language · Computer Science 2025-05-05 Josefa Lia Stoisser , Marc Boubnovski Martell , Julien Fauqueur

Agentic Retrieval-Augmented Generation (RAG) systems enhance Large Language Models (LLMs) by enabling dynamic, multi-step reasoning and information retrieval. However, these systems often exhibit sub-optimal search behaviors like…

Computation and Language · Computer Science 2025-10-10 Peilin Wu , Mian Zhang , Xinlu Zhang , Xinya Du , Zhiyu Zoey Chen

Join query optimization is a complex task and is central to the performance of query processing. In fact it belongs to the class of NP-hard problems. Traditional query optimizers use dynamic programming (DP) methods combined with a set of…

Databases · Computer Science 2019-11-27 Jonas Heitz , Kurt Stockinger

Data analysis is a crucial analytical process to generate in-depth studies and conclusive insights to comprehensively answer a given user query for tabular data. In this work, we aim to propose new resources and benchmarks to inspire future…

Computation and Language · Computer Science 2024-10-30 Xueqing Wu , Rui Zheng , Jingzhen Sha , Te-Lin Wu , Hanyu Zhou , Mohan Tang , Kai-Wei Chang , Nanyun Peng , Haoran Huang

Although the many efforts to apply deep reinforcement learning to query optimization in recent years, there remains room for improvement as query optimizers are complex entities that require hand-designed tuning of workloads and datasets.…

Databases · Computer Science 2023-06-05 Yuri Kim , Yewon Choi , Yujung Gil , Sanghee Lee , Heesik Shin , Jaehyok Chong

Deep learning (DL) models require extensive data to achieve strong performance and generalization. Deep generative models (DGMs) offer a solution by synthesizing data. Yet current approaches for tabular data often fail to preserve feature…

Machine Learning · Computer Science 2026-05-06 Minh H. Vu , Daniel Edler , Carl Wibom , Tommy Löfstedt , Beatrice Melin , Martin Rosvall

Learned optimization has emerged as a promising alternative to hand-crafted optimizers, with the potential to discover stronger learned update rules that enable faster, hyperparameter-free training of neural networks. A critical element for…

Machine Learning · Computer Science 2025-06-23 Abhinav Moudgil , Boris Knyazev , Guillaume Lajoie , Eugene Belilovsky

This study presents a novel computer system performance optimization and adaptive workload management scheduling algorithm based on Q-learning. In modern computing environments, characterized by increasing data volumes, task complexity, and…

Machine Learning · Computer Science 2024-11-11 Pochun Li , Yuyang Xiao , Jinghua Yan , Xuan Li , Xiaoye Wang

Accurate query runtime prediction is a critical component of effective query optimization in modern database systems. Traditional cost models, such as those used in PostgreSQL, rely on static heuristics that often fail to reflect actual…

Databases · Computer Science 2025-10-08 Utsav Pathak , Amit Mankodi

Workload management for cloud databases must deal with the tasks of resource provisioning, query placement and query scheduling in a manner that meets the application's performance goals while minimizing the cost of using cloud resources.…

Databases · Computer Science 2018-09-28 Ryan Marcus , Olga Papaemmanouil

Tabular data synthesis for supervised learning ('SL') model training is gaining popularity in industries such as healthcare, finance, and retail. Despite the progress made in tabular data generators, models trained with synthetic data often…

Machine Learning · Computer Science 2025-07-15 Tung Sum Thomas Kwok , Zeyong Zhang , Chi-Hua Wang , Guang Cheng

Graph databases (GDB) have recently been arisen to overcome the limits of traditional databases for storing and managing data with graph-like structure. Today, they represent a requirement for many applications that manage graph-like data,…

Databases · Computer Science 2016-09-08 Ali Ben Ammar

We address the problem of learning observation models end-to-end for estimation. Robots operating in partially observable environments must infer latent states from multiple sensory inputs using observation models that capture the joint…

Robotics · Computer Science 2022-04-12 Paloma Sodhi , Eric Dexheimer , Mustafa Mukadam , Stuart Anderson , Michael Kaess

Retrieval-Augmented Large Language Models (LLMs), which incorporate the non-parametric knowledge from external knowledge bases into LLMs, have emerged as a promising approach to enhancing response accuracy in several tasks, such as…

Computation and Language · Computer Science 2024-03-29 Soyeong Jeong , Jinheon Baek , Sukmin Cho , Sung Ju Hwang , Jong C. Park

SQL query performance is critical in database applications, and query rewriting is a technique that transforms an original query into an equivalent query with a better performance. In a wide range of database-supported systems, there is a…

Databases · Computer Science 2023-05-16 Qiushi Bai , Sadeem Alsudais , Chen Li

Automatic Prompt Optimization (APO) has emerged as a critical technique for enhancing Large Language Model (LLM) performance, yet current state-of-the-art methods typically rely on large, labeled gold-standard development sets to compute…

Among daily tasks of database administrators (DBAs), the analysis of query workloads to identify schema issues and improving performances is crucial. Although DBAs can easily pinpoint queries repeatedly causing performance issues, it…

Artificial Intelligence · Computer Science 2021-08-10 Youcef Remil , Anes Bendimerad , Romain Mathonat , Philippe Chaleat , Mehdi Kaytoue

Learning to optimize (L2O) is an emerging approach that leverages machine learning to develop optimization methods, aiming at reducing the laborious iterations of hand engineering. It automates the design of an optimization method based on…

Optimization and Control · Mathematics 2021-07-05 Tianlong Chen , Xiaohan Chen , Wuyang Chen , Howard Heaton , Jialin Liu , Zhangyang Wang , Wotao Yin

GraphQL is a query language for APIs and a runtime for executing those queries, fetching the requested data from existing microservices, REST APIs, databases, or other sources. Its expressiveness and its flexibility have made it an…

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