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Machine Learning for Combinatorial Optimization: a Methodological Tour d'Horizon (1811.06128v2)

Published 15 Nov 2018 in cs.LG and stat.ML

Abstract: This paper surveys the recent attempts, both from the machine learning and operations research communities, at leveraging machine learning to solve combinatorial optimization problems. Given the hard nature of these problems, state-of-the-art algorithms rely on handcrafted heuristics for making decisions that are otherwise too expensive to compute or mathematically not well defined. Thus, machine learning looks like a natural candidate to make such decisions in a more principled and optimized way. We advocate for pushing further the integration of machine learning and combinatorial optimization and detail a methodology to do so. A main point of the paper is seeing generic optimization problems as data points and inquiring what is the relevant distribution of problems to use for learning on a given task.

Citations (1,236)

Summary

  • The paper consolidates ML and OR efforts by framing optimization problems as data-driven tasks.
  • It demonstrates how imitation and reinforcement learning methods accelerate and improve traditional heuristics.
  • It outlines integrated algorithmic strategies and future directions to enhance solver adaptability and efficiency.

Machine Learning for Combinatorial Optimization: A Methodological Tour d'Horizon

The paper "Machine Learning for Combinatorial Optimization: a Methodological Tour d'Horizon" by Yoshua Bengio, Andrea Lodi, and Antoine Prouvost, consolidates the efforts from both the ML and operations research (OR) communities to tackle combinatorial optimization (CO) problems. The authors advocate for a deeper integration of ML and CO, promoting the view of optimization problems as data points and emphasizing the importance of learning on a relevant distribution of problems.

Overview

Modern approaches to solving CO problems often rely on handcrafted heuristics due to the computational complexity and the ill-defined nature of traditional methods. ML, particularly its advances in approximate methods, presents a promising alternative. The paper surveys various methodological approaches, categorizing ML contributions to CO into three structural templates and two distinct learning methodologies: demonstration (imitation learning) and experience (reinforcement learning).

Learning Methods in Combinatorial Optimization

Demonstration: Imitation Learning

In the demonstration setting, the learner models its behavior by mimicking an expert's decisions. This method has been employed to accelerate CO heuristics, approximating the outcomes of computationally expensive decisions with ML:

  • Cutting Planes in Non-convex Quadratic Programming: Here, an ML model approximates strong SDP relaxations by predicting the most promising cuts, dramatically reducing computational cost.
  • Branching in Mixed-Integer Linear Programming (MILP): ML models have approximated strong branching decisions in MILP solvers, with methods like decision trees, linear models, and graph neural networks (GNNs) showing improvements in branching efficiency.

Where demonstration enables rapid policy approximation, it is inherently bounded by the performance of the expert or oracle, thus limiting exploration into potentially superior solutions not evident through traditional methods.

Experience: Reinforcement Learning

The experience-based methodology leverages reinforcement learning (RL) to allow the policy to discover novel and potentially superior strategies:

  • Traveling Salesman Problem (TSP): RL-based models, such as those utilizing GNNs, have shown promise in deriving near-optimal solutions by learning from the partial tour lengths as reward signals.
  • Heuristic and Hyper-heuristic Methods: These models explore dynamically adjustable heuristic sequences or hyper-heuristics, leveraging the experience of state-action rewards to fine-tune decision-making processes, even in large search spaces.

RL offers the distinct advantage of continual improvement over the expert by optimizing directly for the performance measure, though this comes at the cost of increased computational and sample complexity.

Algorithmic Structure

ML can be integrated into CO algorithms in several ways:

  • End-to-End Learning: Directly training ML models to output solutions for given instances; effective in domains like TSP but lacks feasibility guarantees.
  • Algorithm Configuration: Using ML to configure algorithmic heuristics, params, or strategies; enhances existing solvers' efficiency without compromising exactness.
  • Embedded Learning: Repeated ML-CO interactions within an overarching solver framework, such as branching in MILP or iterative cutting-plane selection; balances ML flexibility with solver robustness.

Implications and Future Directions

The paper emphasizes multiple layers of generalization in ML for CO—both across problem instances and algorithmic states. RL and fine-tuning combined with meta-learning approaches offer pathways to generalizable and adaptable policies.

Furthermore, the intersection of ML and CO holds promise for both practical and theoretical advancements. Practically, integrating ML into CO solvers can lead to performance boosts in various industries—transportation, supply chain, and beyond. Theoretically, it opens up exploration into new heuristic strategies and decision policies difficult to decipher through traditional means.

Challenges and Considerations

Key challenges include ensuring solution feasibility, effectively modeling problem instances for ML, and addressing the inherent scaling issues. The necessity to generalize from sampled problem distributions to unseen instances remains an overriding concern. Generating rigorous and representative datasets remains a critical step for training robust models.

Conclusion

The survey underscores a symbiotic relationship between ML and CO, highlighting how ML can augment and automate heuristic methodologies in CO algorithms. While many contributions remain exploratory, the potential for substantive improvements in CO problem-solving through ML integration is significantly promising, ushering in a new era for combinatorial optimization approaches.

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