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Register a new userOn the Expressive Power of Self-Attention Matrices
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Added by
Valerii Likhosherstov
Publication date
2021
fields
Informatics Engineering
and research's language is
English
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Transformer networks are able to capture patterns in data coming from many domains (text, images, videos, proteins, etc.) with little or no change to architecture components. We perform a theoretical analysis of the core component responsible for signal propagation between elements, i.e. the self-attention matrix. In practice, this matrix typically exhibits two properties: (1) it is sparse, meaning that each token only attends to a small subset of other tokens; and (2) it changes dynamically depending on the input to the module. With these considerations in mind, we ask the following question: Can a fixed self-attention module approximate arbitrary sparse patterns depending on the input? How small is the hidden size $d$ required for such approximation? We make progress in answering this question and show that the self-attention matrix can provably approximate sparse matrices, where sparsity is in terms of a bounded number of nonzero elements in each row and column. While the parameters of self-attention are fixed, various sparse matrices can be approximated by only modifying the inputs. Our proof is based on the random projection technique and uses the seminal Johnson-Lindenstrauss lemma. Our proof is constructive, enabling us to propose an algorithm for finding adaptive inputs and fixed self-attention parameters in order to approximate a given matrix. In particular, we show that, in order to approximate any sparse matrix up to a given precision defined in terms of preserving matrix element ratios, $d$ grows only logarithmically with the sequence length $L$ (i.e. $d = O(log L)$).
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We study deep neural networks with polynomial activations, particularly their expressive power. For a fixed architecture and activation degree, a polynomial neural network defines an algebraic map from weights to polynomials. The image of this map is the functional space associated to the network, and it is an irreducible algebraic variety upon taking closure. This paper proposes the dimension of this variety as a precise measure of the expressive power of polynomial neural networks. We obtain several theoretical results regarding this dimension as a function of architecture, including an exact formula for high activation degrees, as well as upper and lower bounds on layer widths in order for deep polynomials networks to fill the ambient functional space. We also present computational evidence that it is profitable in terms of expressiveness for layer widths to increase monotonically and then decrease monotonically. Finally, we link our study to favorable optimization properties when training weights, and we draw intriguing connections with tensor and polynomial decompositions.
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We study the expressive power of kernel methods and the algorithmic feasibility of multiple kernel learning for a special rich class of kernels. Specifically, we define emph{Euclidean kernels}, a diverse class that includes most, if not all, families of kernels studied in literature such as polynomial kernels and radial basis functions. We then describe the geometric and spectral structure of this family of kernels over the hypercube (and to some extent for any compact domain). Our structural results allow us to prove meaningful limitations on the expressive power of the class as well as derive several efficient algorithms for learning kernels over different domains.
In recent years, Graph Neural Network (GNN) has bloomly progressed for its power in processing graph-based data. Most GNNs follow a message passing scheme, and their expressive power is mathematically limited by the discriminative ability of the Weisfeiler-Lehman (WL) test. Following Tinhofers research on compact graphs, we propose a variation of the message passing scheme, called the Weisfeiler-Lehman-Tinhofer GNN (WLT-GNN), that theoretically breaks through the limitation of the WL test. In addition, we conduct comparative experiments and ablation studies on several well-known datasets. The results show that the proposed methods have comparable performances and better expressive power on these datasets.
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