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A general framework of unsupervised learning for combinatorial optimization (CO) is to train a neural network (NN) whose output gives a problem solution by directly optimizing the CO objective. Albeit with some advantages over traditional…

机器学习 · 计算机科学 2023-01-24 Haoyu Wang , Pan Li

Branch and Bound (B&B) is the exact tree search method typically used to solve Mixed-Integer Linear Programming problems (MILPs). Learning branching policies for MILP has become an active research area, with most works proposing to imitate…

机器学习 · 计算机科学 2021-06-04 Giulia Zarpellon , Jason Jo , Andrea Lodi , Yoshua Bengio

This paper proposes Branch & Learn, a framework for Predict+Optimize to tackle optimization problems containing parameters that are unknown at the time of solving. Given an optimization problem solvable by a recursive algorithm satisfying…

机器学习 · 计算机科学 2022-05-05 Xinyi Hu , Jasper C. H. Lee , Jimmy H. M. Lee , Allen Z. Zhong

Neural Combinatorial Optimization (NCO) has emerged as a powerful framework for solving combinatorial optimization problems by integrating deep learning-based models. This work focuses on improving existing inference techniques to enhance…

Neural Combinatorial Optimization attempts to learn good heuristics for solving a set of problems using Neural Network models and Reinforcement Learning. Recently, its good performance has encouraged many practitioners to develop neural…

人工智能 · 计算机科学 2022-05-04 Andoni I. Garmendia , Josu Ceberio , Alexander Mendiburu

We establish a broad methodological foundation for mixed-integer optimization with learned constraints. We propose an end-to-end pipeline for data-driven decision making in which constraints and objectives are directly learned from data…

Recent advances in deep learning have enabled optimization of deep reactive policies (DRPs) for continuous MDP planning by encoding a parametric policy as a deep neural network and exploiting automatic differentiation in an end-to-end…

人工智能 · 计算机科学 2022-03-25 Siow Meng Low , Akshat Kumar , Scott Sanner

Structure-Based molecule optimization (SBMO) aims to optimize molecules with both continuous coordinates and discrete types against protein targets. A promising direction is to exert gradient guidance on generative models given its…

生物大分子 · 定量生物学 2025-06-06 Keyue Qiu , Yuxuan Song , Jie Yu , Hongbo Ma , Ziyao Cao , Zhilong Zhang , Yushuai Wu , Mingyue Zheng , Hao Zhou , Wei-Ying Ma

Modern multi-agent systems ranging from sensor networks monitoring critical infrastructure to crowdsourcing platforms aggregating human intelligence can suffer significant performance degradation due to systematic biases that vary with…

机器学习 · 计算机科学 2025-10-31 Siavash M. Alamouti , Fay Arjomandi

Imitation Learning (IL) has proven highly effective for robotic and control tasks where manually designing reward functions or explicit controllers is infeasible. However, standard IL methods implicitly assume that the environment dynamics…

机器学习 · 计算机科学 2025-11-12 Rishabh Agrawal , Yusuf Alvi , Rahul Jain , Ashutosh Nayyar

Bayesian optimization is a class of data efficient model based algorithms typically focused on global optimization. We consider the more general case where a user is faced with multiple problems that each need to be optimized conditional on…

机器学习 · 统计学 2020-11-04 Michael Pearce , Janis Klaise , Matthew Groves

Efficient computation in deep neural networks is crucial for real-time object detection. However, recent advancements primarily result from improved high-performing hardware rather than improving parameters and FLOP efficiency. This is…

计算机视觉与模式识别 · 计算机科学 2025-07-25 Lilian Hollard , Lucas Mohimont , Nathalie Gaveau , Luiz Angelo Steffenel

Robustness of machine learning models to various adversarial and non-adversarial corruptions continues to be of interest. In this paper, we introduce the notion of the boundary thickness of a classifier, and we describe its connection with…

This paper is a short report about our work for the primal task in the Machine Learning for Combinatorial Optimization NeurIPS 2021 Competition. For each dataset of our interest in the competition, we propose customized primal heuristic…

This paper proposes a novel primal heuristic for Mixed Integer Programs, by employing machine learning techniques. Mixed Integer Programming is a general technique for formulating combinatorial optimization problems. Inside a solver, primal…

人工智能 · 计算机科学 2021-07-05 Yunzhuang Shen , Yuan Sun , Andrew Eberhard , Xiaodong Li

We propose a hierarchical architecture for efficiently computing high-quality solutions to structured mixed-integer programs (MIPs). To reduce computational effort, our approach decouples the original problem into a higher level problem and…

最优化与控制 · 数学 2025-12-04 Stefan Clarke , Bartolomeo Stellato

Learning-enabled control systems increasingly rely on multiple sensing modalities (e.g., vision, audio, language, etc.) for perception and decision support. A key challenge is that multi-modal sensor training dynamics are often imbalanced:…

机器学习 · 计算机科学 2026-04-01 Heshan Fernando , Quan Xiao , Parikshit Ram , Yi Zhou , Horst Samulowitz , Nathalie Baracaldo , Tianyi Chen

Many real-world scientific and industrial applications require the optimization of expensive black-box functions. Bayesian Optimization (BO) provides an effective framework for such problems. However, traditional BO methods are prone to get…

人工智能 · 计算机科学 2025-09-29 Zhuo Yang , Daolang Wang , Lingli Ge , Beilun Wang , Tianfan Fu , Yuqiang Li

Despite the high performance achieved by deep neural networks on various tasks, extensive studies have demonstrated that small tweaks in the input could fail the model predictions. This issue of deep neural networks has led to a number of…

机器学习 · 计算机科学 2022-02-22 Ming-Chang Chiu , Xuezhe Ma

Neural Combinatorial Optimization (NCO) has emerged as a promising approach for NP-hard problems. However, prevailing RL-based methods suffer from low sample efficiency due to sparse rewards and underused solutions. We propose Best-anchored…

机器学习 · 计算机科学 2025-06-03 Zijun Liao , Jinbiao Chen , Debing Wang , Zizhen Zhang , Jiahai Wang