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.

The modern study and use of surfaces is a research topic grounded in centuries of mathematical and empirical inquiry. From a mathematical point of view, curvature is an invariant that characterises the intrinsic geometry and the extrinsic shape of a surface. Yet, in modern applications the focus has shifted away from finding expressive representations of surfaces, and towards the design of efficient neural network architectures to process them. The literature suggests a tendency to either overlook the representation of the processed surface, or use overcomplicated representations whose ability to capture the essential features of a surface is opaque. We propose using curvature as the input of neural network architectures for surface processing, and explore this proposition through experiments making use of the shape operator. Our results show that using curvature as input leads to significant a increase in performance on segmentation and classification tasks, while allowing far less computational overhead than current methods.

Quantum computers have the potential to revolutionize diverse fields, including quantum chemistry, materials science, and machine learning. However, contemporary quantum computers experience errors that often cause quantum programs run on them to fail. Until quantum computers can reliably execute large quantum programs, stakeholders will need fast and reliable methods for assessing a quantum computer's capability--i.e., the programs it can run and how well it can run them. Previously, off-the-shelf neural network architectures have been used to model quantum computers' capabilities, but with limited success, because these networks fail to learn the complex quantum physics that determines real quantum computers' errors. We address this shortcoming with a new quantum-physics-aware neural network architecture for learning capability models. Our scalable architecture combines aspects of graph neural networks with efficient approximations to the physics of errors in quantum programs. This approach achieves up to $\sim50\%$ reductions in mean absolute error on both experimental and simulated data, over state-of-the-art models based on convolutional neural networks, and scales to devices with 100+ qubits.

Bayesian Optimisation (BO) refers to a class of methods for global optimisation of a function f which is only accessible via point evaluations. It is typically used in settings where f is expensive to evaluate. A common use case for BO in machine learning is model selection, where it is not possible to analytically model the generalisation performance of a statistical model, and we resort to noisy and expensive training and validation procedures to choose the best model. Conventional BO methods have focused on Euclidean and categorical domains, which, in the context of model selection, only permits tuning scalar hyper-parameters of machine learning algorithms. However, with the surge of interest in deep learning, there is an increasing demand to tune neural network architectures. In this work, we develop NASBOT, a Gaussian process based BO framework for neural architecture search. To accomplish this, we develop a distance metric in the space of neural network architectures which can be computed efficiently via an optimal transport program. This distance might be of independent interest to the deep learning community as it may find applications outside of BO. We demonstrate that NASBOT outperforms other alternatives for architecture search in several cross validation based model selection tasks on multi-layer perceptrons and convolutional neural networks.

Automatic neural architecture design has shown its potential in discovering powerful neural network architectures. Existing methods, no matter based on reinforcement learning or evolutionary algorithms (EA), conduct architecture search in a discrete space, which is highly inefficient. In this paper, we propose a simple and efficient method to automatic neural architecture design based on continuous optimization. We call this new approach neural architecture optimization (NAO). There are three key components in our proposed approach: (1) An encoder embeds/maps neural network architectures into a continuous space.

In this paper we propose a generalization of this work that generally exhibits improved performace, but from an implementation point of view is actually simpler.

Such a better embedding is then decoded to a network by the decoder.

This paper presents a text classification algorithm inspired by the notion of superposition of states in quantum physics.

The Job Shop Scheduling (JSS) problem can be viewed as an integer optimization program with linear objective function and linear, disjunctive constraints. Theconstraints(14c)enforceprecedencebetween tasks that must be scheduled in the specified order within their respective job. Themodel presented belowisusedtoconstruct solutions that are integral, and feasible tothe original problem constraints. However, the resolution frequency to solve OPFs is limited by their computational complexity. Additionally,the stochasticity introduced by renewable energy sources further increases the number of scenarios to consider. C.2 DatasetDetails Table 4 describes the power network benchmarks used, including the number of buses|N|, and transmission lines/transformers |E|.