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Samantha Chen

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3 papers
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3

NeurIPS Conference 2025 Conference Paper

Effective Neural Approximations for Geometric Optimization Problems

  • Samantha Chen
  • Oren Ciolli
  • Anastasios Sidiropoulos
  • Yusu Wang

Neural networks offer a promising data-driven approach to tackle computationally challenging optimization problems. In this work, we introduce neural approximation frameworks for a family of geometric "extent measure" problems, including shape-fitting descriptors (e. g. minimum enclosing ball or annulus). Central to our approach is the \textit{alignment} of our neural model with a new variant of the classical $\varepsilon$-kernel technique from computational geometry. In particular, we develop a new relaxed-$\varepsilon$-kernel theory that maintains the approximation guarantees of the classical $\varepsilon$-kernels but with the crucial benefit that it can be easily implemented with \textit{bounded model complexity} (i. e, constant number of parameters) by the simple SumFormer neural network. This leads to a simple neural model to approximate objects such as the directional width of any input point set, and empirically shows excellent out-of-distribution generalization. Many geometric extent measures, such as the minimum enclosing spherical shell, cannot be directly captured by $\varepsilon$-kernels. To this end, we show that an encode-process-decode framework with our kernel approximating NN used as the ``process'' module can approximate such extent measures, again, with bounded model complexity where parameters scale only with the approximation error $\varepsilon$ and not the size of the input set. Empirical results on diverse point‐cloud datasets demonstrate the practical performance of our models.

AAAI Conference 2024 Conference Paper

Learning Ultrametric Trees for Optimal Transport Regression

  • Samantha Chen
  • Puoya Tabaghi
  • Yusu Wang

Optimal transport provides a metric which quantifies the dissimilarity between probability measures. For measures supported in discrete metric spaces, finding the optimal transport distance has cubic time complexity in the size of the space. However, measures supported on trees admit a closed-form optimal transport that can be computed in linear time. In this paper, we aim to find an optimal tree structure for a given discrete metric space so that the tree-Wasserstein distance approximates the optimal transport distance in the original space. One of our key ideas is to cast the problem in ultrametric spaces. This helps us optimize over the space of ultrametric trees --- a mixed-discrete and continuous optimization problem --- via projected gradient decent over the space of ultrametric matrices. During optimization, we project the parameters to the ultrametric space via a hierarchical minimum spanning tree algorithm, equivalent to the closest projection to ultrametrics under the supremum norm. Experimental results on real datasets show that our approach outperforms previous approaches (e.g. Flowtree, Quadtree) in approximating optimal transport distances. Finally, experiments on synthetic data generated on ground truth trees show that our algorithm can accurately uncover the underlying trees.

NeurIPS Conference 2023 Conference Paper

Neural approximation of Wasserstein distance via a universal architecture for symmetric and factorwise group invariant functions

  • Samantha Chen
  • Yusu Wang

Learning distance functions between complex objects, such as the Wasserstein distance to compare point sets, is a common goal in machine learning applications. However, functions on such complex objects (e. g. , point sets and graphs) are often required to be invariant to a wide variety of group actions e. g. permutation or rigid transformation. Therefore, continuous and symmetric *product* functions (such as distance functions) on such complex objects must also be invariant to the *product* of such group actions. We call these functions symmetric and factor-wise group invariant functions (or SGFI functions} in short). In this paper, we first present a general neural network architecture for approximating SFGI functions. The main contribution of this paper combines this general NN with a sketching idea in order to develop a specific and efficient neural network which can approximate the $p$-th Wasserstein distance between point sets. Very importantly, the required model complexity is *independent* of the sizes of input point sets. On the theoretical front, to the best of our knowledge, this is the first result showing that there exists a neural network with the capacity to approximate Wasserstein distance with bounded model complexity. Our work provides an interesting integration of sketching ideas for geometric problems with universal approximation of symmetric functions. On the empirical front, we present a range of results showing that our newly proposed neural network architecture performs comparatively or better than other models (including a SOTA Siamese Autoencoder based approach). In particular, our NN generalizes significantly better and trains much faster than the SOTA Siamese AE. Finally, this line of investigation could be useful in exploring effective neural network design for solving a broad range of geometric optimization problems (e. g. , $k$-means in a metric space).

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