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Reinforcement learning (RL) is typically concerned with estimating stationary policies or single-step models, leveraging the Markov property to factorize problems in time. However, we can also view RL as a generic sequence modeling problem,…

Machine Learning · Computer Science 2021-11-30 Michael Janner , Qiyang Li , Sergey Levine

This study presents a novel approach to addressing offline reinforcement learning (RL) problems by reframing them as regression tasks that can be effectively solved using Decision Trees. Mainly, we introduce two distinct frameworks:…

Machine Learning · Computer Science 2024-10-16 Prajwal Koirala , Cody Fleming

Reactive synthesis algorithms allow automatic construction of policies to control an environment modeled as a Markov Decision Process (MDP) that are optimal with respect to high-level temporal logic specifications. However, they assume that…

Formal Languages and Automata Theory · Computer Science 2022-05-31 Rajeev Alur , Suguman Bansal , Osbert Bastani , Kishor Jothimurugan

High Performance Computing (HPC) systems are used across a wide range of disciplines for both large and complex computations. HPC systems often receive many thousands of computational tasks at a time, colloquially referred to as jobs. These…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-04-16 Elliot Kolker-Hicks , Di Zhang , Dong Dai

This article presents resource-guided synthesis, a technique for synthesizing recursive programs that satisfy both a functional specification and a symbolic resource bound. The technique is type-directed and rests upon a novel type system…

Programming Languages · Computer Science 2019-04-19 Tristan Knoth , Di Wang , Nadia Polikarpova , Jan Hoffmann

Traditional approaches in offline reinforcement learning aim to learn the optimal policy that maximizes the cumulative reward, also known as return. It is increasingly important to adjust the performance of AI agents to meet human…

Machine Learning · Computer Science 2025-06-23 Tsunehiko Tanaka , Kenshi Abe , Kaito Ariu , Tetsuro Morimura , Edgar Simo-Serra

Controller synthesis is in essence a case of model-based planning for non-deterministic environments in which plans (actually ''strategies'') are meant to preserve system goals indefinitely. In the case of supervisory control environments…

Machine Learning · Computer Science 2023-05-05 Tomás Delgado , Marco Sánchez Sorondo , Víctor Braberman , Sebastián Uchitel

We introduce a mathematical framework for retrosynthetic analysis, an important research method in synthetic chemistry. Our approach represents molecules and their interaction using string diagrams in layered props - a recently introduced…

Logic in Computer Science · Computer Science 2023-11-08 Ella Gale , Leo Lobski , Fabio Zanasi

Teaching a computer to read and answer general questions pertaining to a document is a challenging yet unsolved problem. In this paper, we describe a novel neural network architecture called the Reasoning Network (ReasoNet) for machine…

Machine Learning · Computer Science 2017-06-21 Yelong Shen , Po-Sen Huang , Jianfeng Gao , Weizhu Chen

Offline Reinforcement Learning (RL) aims to learn effective policies from a static dataset without requiring further agent-environment interactions. However, its practical adoption is often hindered by the need for explicit reward…

Machine Learning · Computer Science 2025-12-23 Gaurav Chaudhary , Laxmidhar Behera

We cast retrosynthesis as a machine translation problem by introducing a special Tensor2Tensor, an entire attention-based and fully data-driven model. Given a data set comprising about 50,000 diverse reactions extracted from USPTO patents,…

Chemical Physics · Physics 2019-08-05 Hongliang Duan , Ling Wang , Chengyun Zhang , Jianjun Li

Reinforcement learning (RL) presents a promising framework to learn policies through environment interaction, but often requires an infeasible amount of interaction data to solve complex tasks from sparse rewards. One direction includes…

Machine Learning · Computer Science 2024-05-07 Stone Tao , Arth Shukla , Tse-kai Chan , Hao Su

We present an attention-based Transformer model for automatic retrosynthesis route planning. Our approach starts from reactants prediction of single-step organic reactions for given products, followed by Monte Carlo tree search-based…

Quantitative Methods · Quantitative Biology 2019-06-07 Kangjie Lin , Youjun Xu , Jianfeng Pei , Luhua Lai

Machine learning models now influence decisions that directly affect people's lives, making it important to understand not only their predictions, but also how individuals could act to obtain better results. Algorithmic recourse provides…

Machine Learning · Computer Science 2026-02-10 Bohdan Turbal , Iryna Voitsitska , Lesia Semenova

Offline reinforcement learning (RL) has emerged as a prevalent and effective methodology for real-world recommender systems, enabling learning policies from historical data and capturing user preferences. In offline RL, reward shaping…

Information Retrieval · Computer Science 2025-07-01 Wenzheng Shu , Yanxiang Zeng , Yongxiang Tang , Teng Sha , Ning Luo , Yanhua Cheng , Xialong Liu , Fan Zhou , Peng Jiang

We consider real-world reinforcement learning (RL) of robotic manipulation tasks that involve both visuomotor skills and contact-rich skills. We aim to train a policy that maps multimodal sensory observations (vision and force) to a…

Robotics · Computer Science 2022-03-01 Jun Jin , Daniel Graves , Cameron Haigh , Jun Luo , Martin Jagersand

Logic synthesis is one of the most important steps in design and implementation of digital chips with a big impact on final Quality of Results (QoR). For a most general input circuit modeled by a Directed Acyclic Graph (DAG), many logic…

Artificial Intelligence · Computer Science 2023-02-14 Ghasem Pasandi , Sreedhar Pratty , James Forsyth

The offline reinforcement learning (RL) setting (also known as full batch RL), where a policy is learned from a static dataset, is compelling as progress enables RL methods to take advantage of large, previously-collected datasets, much…

Machine Learning · Computer Science 2021-02-09 Justin Fu , Aviral Kumar , Ofir Nachum , George Tucker , Sergey Levine

Reinforcement learning (RL) has shown great promise with algorithms learning in environments with large state and action spaces purely from scalar reward signals. A crucial challenge for current deep RL algorithms is that they require a…

Machine Learning · Computer Science 2023-11-23 Shivakanth Sujit , Pedro H. M. Braga , Jorg Bornschein , Samira Ebrahimi Kahou

As a fundamental task in computational chemistry, retrosynthesis prediction aims to identify a set of reactants to synthesize a target molecule. Existing template-free approaches only consider the graph structures of the target molecule,…

Computation and Language · Computer Science 2024-01-29 Yifeng Liu , Hanwen Xu , Tangqi Fang , Haocheng Xi , Zixuan Liu , Sheng Zhang , Hoifung Poon , Sheng Wang
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