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Group-invariant tensor train networks for supervised learning (2206.15051v2)

Published 30 Jun 2022 in cs.LG, cs.NA, and math.NA

Abstract: Invariance has recently proven to be a powerful inductive bias in machine learning models. One such class of predictive or generative models are tensor networks. We introduce a new numerical algorithm to construct a basis of tensors that are invariant under the action of normal matrix representations of an arbitrary discrete group. This method can be up to several orders of magnitude faster than previous approaches. The group-invariant tensors are then combined into a group-invariant tensor train network, which can be used as a supervised machine learning model. We applied this model to a protein binding classification problem, taking into account problem-specific invariances, and obtained prediction accuracy in line with state-of-the-art deep learning approaches.

Summary

  • The paper introduces group-invariant tensor train networks (TTNs) for supervised learning, leveraging representation theory and a novel efficient algorithm to impose invariance constraints.
  • Numerical experiments, such as protein binding classification with DNA sequences, demonstrate that these invariant TTNs achieve competitive prediction accuracy compared to state-of-the-art deep learning models.
  • The research shows that respecting problem-specific invariances can improve model generalization and opens avenues for applying these principles to other neural network architectures and inductive biases.

Insightful Overview of the Paper "Group-invariant tensor train networks for supervised learning"

The paper authored by Brent Sprangers and Nick Vannieuwenhoven presents a comprehensive exploration into group-invariant tensor train networks, specifically designed for applications in supervised learning. The foundation of their research rests on the interplay between group-invariance and tensor networks, utilizing the mathematical framework from representation theory to impose invariance constraints effectively and efficiently.

Key Contributions and Methodology

Sprangers and Vannieuwenhoven introduce a novel numerical algorithm aimed at constructing bases of group-invariant tensors under the action of discrete groups with normal matrices. This enhanced efficiency is claimed to outperform existing methodologies by orders of magnitude, highlighting a significant computational advancement in tensor representation theory.

The central methodology hinges upon constructing group-invariant tensor train networks (TTNs), where each core tensor respects specific invariance properties as dictated by finite group actions. By leveraging representation theory, the paper demonstrates that invariant tensors form a subrepresentation, allowing for efficient basis construction. The authors provide a newly developed algorithm, reducing the dimension of the problem's search space, minimizing storage requirements, and decreasing computational overhead.

Numerical Results and Experimental Validation

The authors validate their theoretical innovations through a series of experiments, notably within the field of protein binding classification problems. By incorporating problem-specific invariance considerations, such as reverse complement (RC) invariance in DNA sequences, the group-invariant TTNs achieved competitive prediction accuracy akin to that of state-of-the-art deep learning models. These numerical results underscore the practical utility of their approach, indicating robustness and scalability.

Theoretical Implications and Future Directions

The theoretical implications of this research are profound: it marries tensor network methodologies with the rigorous application of representation theory for practical machine learning challenges. The authors suggest that by respecting problem-specific invariances, the models tend to generalize better, which is corroborated by their empirical findings.

Future research may explore extending these invariance principles across other neural network architectures, potentially widening the applicability of structured tensor networks. Additionally, exploring the collaboration between tensor network decompositions and other inductive biases in machine learning could yield intriguing insights, especially in domains requiring high-dimensional data processing.

Conclusion

Sprangers and Vannieuwenhoven successfully present an advanced approach to constructing group-invariant tensor trains, offering impactful insights into machine learning with constrained tensor networks. Their framework is positioned as not only theoretically sound but also practically effective, marking a pivotal contribution to the domain of computational learning models. Further exploration in enhancing the utility and efficiency of invariant tensor networks stands as a promising avenue for both academic inquiry and real-world application.

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