Choiceless Polynomial Time (CPT) is one of the few remaining candidate logics for capturing PTIME. In this paper, we make progress towards separating CPT from polynomial time by firstly establishing a connection between the expressive power of CPT and the existence of certain symmetric circuit families, and secondly, proving lower bounds against these circuits. We focus on the isomorphism problem of unordered Cai-F\"urer-Immerman-graphs (the CFI-query) as a potential candidate for separating CPT from P. Results by Dawar, Richerby and Rossman, and subsequently by Pakusa, Schalth\"ofer and Selman show that the CFI-query is CPT-definable on linearly ordered and preordered base graphs with small colour classes. We define a class of CPT-algorithms, that we call "CFI-symmetric algorithms", which generalises all the known ones, and show that such algorithms can only define the CFI-query on a given class of base graphs if there exists a family of symmetric XOR-circuits with certain properties. These properties include that the circuits have the same symmetries as the base graphs, are of polynomial size, and satisfy certain fan-in restrictions. Then we prove that such circuits with slightly strengthened requirements (i.e. stronger symmetry and fan-in and fan-out restrictions) do not exist for the n-dimensional hypercubes as base graphs. This almost separates the CFI-symmetric algorithms from polynomial time - up to the gap that remains between the circuits whose existence we can currently disprove and the circuits whose existence is necessary for the definability of the CFI-query by a CFI-symmetric algorithm.
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Additive Noise Models (ANM) encode a popular functional assumption that enables learning causal structure from observational data. Due to a lack of real-world data meeting the assumptions, synthetic ANM data are often used to evaluate causal discovery algorithms. Reisach et al. (2021) show that, for common simulation parameters, a variable ordering by increasing variance is closely aligned with a causal order and introduce var-sortability to quantify the alignment. Here, we show that not only variance, but also the fraction of a variable's variance explained by all others, as captured by the coefficient of determination $R^2$, tends to increase along the causal order. Simple baseline algorithms can use $R^2$-sortability to match the performance of established methods. Since $R^2$-sortability is invariant under data rescaling, these algorithms perform equally well on standardized or rescaled data, addressing a key limitation of algorithms exploiting var-sortability. We characterize and empirically assess $R^2$-sortability for different simulation parameters. We show that all simulation parameters can affect $R^2$-sortability and must be chosen deliberately to control the difficulty of the causal discovery task and the real-world plausibility of the simulated data. We provide an implementation of the sortability measures and sortability-based algorithms in our library CausalDisco (//github.com/CausalDisco/CausalDisco).
In the medical images field, semantic segmentation is one of the most important, yet difficult and time-consuming tasks to be performed by physicians. Thanks to the recent advancement in the Deep Learning models regarding Computer Vision, the promise to automate this kind of task is getting more and more realistic. However, many problems are still to be solved, like the scarce availability of data and the difficulty to extend the efficiency of highly specialised models to general scenarios. Organs at risk segmentation for radiotherapy treatment planning falls in this category, as the limited data available negatively affects the possibility to develop general-purpose models; in this work, we focus on the possibility to solve this problem by presenting three types of ensembles of single-organ models able to produce multi-organ masks exploiting the different specialisations of their components. The results obtained are promising and prove that this is a possible solution to finding efficient multi-organ segmentation methods.
Continuous-time measurements are instrumental for a multitude of tasks in quantum engineering and quantum control, including the estimation of dynamical parameters of open quantum systems monitored through the environment. However, such measurements do not extract the maximum amount of information available in the output state, so finding alternative optimal measurement strategies is a major open problem. In this paper we solve this problem in the setting of discrete-time input-output quantum Markov chains. We present an efficient algorithm for optimal estimation of one-dimensional dynamical parameters which consists of an iterative procedure for updating a `measurement filter' operator and determining successive measurement bases for the output units. A key ingredient of the scheme is the use of a coherent quantum absorber as a way to post-process the output after the interaction with the system. This is designed adaptively such that the joint system and absorber stationary state is pure at a reference parameter value. The scheme offers an exciting prospect for optimal continuous-time adaptive measurements, but more work is needed to find realistic practical implementations.
We describe a fast method for solving elliptic partial differential equations (PDEs) with uncertain coefficients using kernel interpolation at a lattice point set. By representing the input random field of the system using the model proposed by Kaarnioja, Kuo, and Sloan (SIAM J.~Numer.~Anal.~2020), in which a countable number of independent random variables enter the random field as periodic functions, it was shown by Kaarnioja, Kazashi, Kuo, Nobile, and Sloan (Numer.~Math.~2022) that the lattice-based kernel interpolant can be constructed for the PDE solution as a function of the stochastic variables in a highly efficient manner using fast Fourier transform (FFT). In this work, we discuss the connection between our model and the popular ``affine and uniform model'' studied widely in the literature of uncertainty quantification for PDEs with uncertain coefficients. We also propose a new class of weights entering the construction of the kernel interpolant -- \emph{serendipitous weights} -- which dramatically improve the computational performance of the kernel interpolant for PDE problems with uncertain coefficients, and allow us to tackle function approximation problems up to very high dimensionalities. Numerical experiments are presented to showcase the performance of the serendipitous weights.
Balanced hypergraph partitioning is an NP-hard problem with many applications, e.g., optimizing communication in distributed data placement problems. The goal is to place all nodes across $k$ different blocks of bounded size, such that hyperedges span as few parts as possible. This problem is well-studied in sequential and distributed settings, but not in shared-memory. We close this gap by devising efficient and scalable shared-memory algorithms for all components employed in the best sequential solvers without compromises with regards to solution quality. This work presents the scalable and high-quality hypergraph partitioning framework Mt-KaHyPar. Its most important components are parallel improvement algorithms based on the FM algorithm and maximum flows, as well as a parallel clustering algorithm for coarsening - which are used in a multilevel scheme with $\log(n)$ levels. As additional components, we parallelize the $n$-level partitioning scheme, devise a deterministic version of our algorithm, and present optimizations for plain graphs. We evaluate our solver on more than 800 graphs and hypergraphs, and compare it with 25 different algorithms from the literature. Our fastest configuration outperforms almost all existing hypergraph partitioners with regards to both solution quality and running time. Our highest-quality configuration achieves the same solution quality as the best sequential partitioner KaHyPar, while being an order of magnitude faster with ten threads. Thus, two of our configurations occupy all fronts of the Pareto curve for hypergraph partitioning. Furthermore, our solvers exhibit good speedups, e.g., 29.6x in the geometric mean on 64 cores (deterministic), 22.3x ($\log(n)$-level), and 25.9x ($n$-level).
Data in Knowledge Graphs often represents part of the current state of the real world. Thus, to stay up-to-date the graph data needs to be updated frequently. To utilize information from Knowledge Graphs, many state-of-the-art machine learning approaches use embedding techniques. These techniques typically compute an embedding, i.e., vector representations of the nodes as input for the main machine learning algorithm. If a graph update occurs later on -- specifically when nodes are added or removed -- the training has to be done all over again. This is undesirable, because of the time it takes and also because downstream models which were trained with these embeddings have to be retrained if they change significantly. In this paper, we investigate embedding updates that do not require full retraining and evaluate them in combination with various embedding models on real dynamic Knowledge Graphs covering multiple use cases. We study approaches that place newly appearing nodes optimally according to local information, but notice that this does not work well. However, we find that if we continue the training of the old embedding, interleaved with epochs during which we only optimize for the added and removed parts, we obtain good results in terms of typical metrics used in link prediction. This performance is obtained much faster than with a complete retraining and hence makes it possible to maintain embeddings for dynamic Knowledge Graphs.
Click-through rate (CTR) prediction plays a critical role in recommender systems and online advertising. The data used in these applications are multi-field categorical data, where each feature belongs to one field. Field information is proved to be important and there are several works considering fields in their models. In this paper, we proposed a novel approach to model the field information effectively and efficiently. The proposed approach is a direct improvement of FwFM, and is named as Field-matrixed Factorization Machines (FmFM, or $FM^2$). We also proposed a new explanation of FM and FwFM within the FmFM framework, and compared it with the FFM. Besides pruning the cross terms, our model supports field-specific variable dimensions of embedding vectors, which acts as soft pruning. We also proposed an efficient way to minimize the dimension while keeping the model performance. The FmFM model can also be optimized further by caching the intermediate vectors, and it only takes thousands of floating-point operations (FLOPs) to make a prediction. Our experiment results show that it can out-perform the FFM, which is more complex. The FmFM model's performance is also comparable to DNN models which require much more FLOPs in runtime.
Graph Neural Networks (GNNs) have proven to be useful for many different practical applications. However, many existing GNN models have implicitly assumed homophily among the nodes connected in the graph, and therefore have largely overlooked the important setting of heterophily, where most connected nodes are from different classes. In this work, we propose a novel framework called CPGNN that generalizes GNNs for graphs with either homophily or heterophily. The proposed framework incorporates an interpretable compatibility matrix for modeling the heterophily or homophily level in the graph, which can be learned in an end-to-end fashion, enabling it to go beyond the assumption of strong homophily. Theoretically, we show that replacing the compatibility matrix in our framework with the identity (which represents pure homophily) reduces to GCN. Our extensive experiments demonstrate the effectiveness of our approach in more realistic and challenging experimental settings with significantly less training data compared to previous works: CPGNN variants achieve state-of-the-art results in heterophily settings with or without contextual node features, while maintaining comparable performance in homophily settings.
Training machine learning models in a meaningful order, from the easy samples to the hard ones, using curriculum learning can provide performance improvements over the standard training approach based on random data shuffling, without any additional computational costs. Curriculum learning strategies have been successfully employed in all areas of machine learning, in a wide range of tasks. However, the necessity of finding a way to rank the samples from easy to hard, as well as the right pacing function for introducing more difficult data can limit the usage of the curriculum approaches. In this survey, we show how these limits have been tackled in the literature, and we present different curriculum learning instantiations for various tasks in machine learning. We construct a multi-perspective taxonomy of curriculum learning approaches by hand, considering various classification criteria. We further build a hierarchical tree of curriculum learning methods using an agglomerative clustering algorithm, linking the discovered clusters with our taxonomy. At the end, we provide some interesting directions for future work.
Clustering is one of the most fundamental and wide-spread techniques in exploratory data analysis. Yet, the basic approach to clustering has not really changed: a practitioner hand-picks a task-specific clustering loss to optimize and fit the given data to reveal the underlying cluster structure. Some types of losses---such as k-means, or its non-linear version: kernelized k-means (centroid based), and DBSCAN (density based)---are popular choices due to their good empirical performance on a range of applications. Although every so often the clustering output using these standard losses fails to reveal the underlying structure, and the practitioner has to custom-design their own variation. In this work we take an intrinsically different approach to clustering: rather than fitting a dataset to a specific clustering loss, we train a recurrent model that learns how to cluster. The model uses as training pairs examples of datasets (as input) and its corresponding cluster identities (as output). By providing multiple types of training datasets as inputs, our model has the ability to generalize well on unseen datasets (new clustering tasks). Our experiments reveal that by training on simple synthetically generated datasets or on existing real datasets, we can achieve better clustering performance on unseen real-world datasets when compared with standard benchmark clustering techniques. Our meta clustering model works well even for small datasets where the usual deep learning models tend to perform worse.
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