Local Search GFlowNets

Minsu Kim, Taeyoung Yun, Emmanuel Bengio, Dinghuai Zhang, Y. Bengio +2 more
10/1/2023

No official code found. Best implementation: dbsxodud-11/ls_gfn (26 stars, last commit 2025-02-27).

Abstract

Generative Flow Networks (GFlowNets) are amortized sampling methods that learn a distribution over discrete objects proportional to their rewards. GFlowNets exhibit a remarkable ability to generate diverse samples, yet occasionally struggle to consistently produce samples with high rewards due to over-exploration on wide sample space. This paper proposes to train GFlowNets with local search, which focuses on exploiting high-rewarded sample space to resolve this issue. Our main idea is to explore the local neighborhood via backtracking and reconstruction guided by backward and forward policies, respectively. This allows biasing the samples toward high-reward solutions, which is not possible for a typical GFlowNet solution generation scheme, which uses the forward policy to generate the solution from scratch. Extensive experiments demonstrate a remarkable performance improvement in several biochemical tasks. Source code is available: \url{https://github.com/dbsxodud-11/ls_gfn}.

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Code Implementations(1)

dbsxodud-11/ls_gfnCommunity100%

Official Code for Local Search GFlowNets (ICLR 2024 Spotlight)

264Shell, PythonOct 5, 20231 years ago

Cite this paper

@article{kim2023local,
  title  = {Local Search GFlowNets},
  author = {Minsu Kim and Taeyoung Yun and Emmanuel Bengio and Dinghuai Zhang and Y. Bengio and Sungsoo Ahn and Jinkyoo Park},
  year   = {2023},
  eprint = {2310.02710},
  archivePrefix = {arXiv},
  url    = {https://arxiv.org/pdf/2310.02710},
  journal = {ICLR 2023 2023}
}

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