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Deep Learning (DL), in particular deep neural networks (DNN), by design is purely data-driven and in general does not require physics. This is the strength of DL but also one of its key limitations when applied to science and engineering problems in which underlying physical properties (such as stability, conservation, and positivity) and desired accuracy need to be achieved. DL methods in their original forms are not capable of respecting the underlying mathematical models or achieving desired accuracy even in big-data regimes. On the other hand, many data-driven science and engineering problems, such as inverse problems, typically have limited experimental or observational data, and DL would overfit the data in this case. Leveraging information encoded in the underlying mathematical models, we argue, not only compensates missing information in low data regimes but also provides opportunities to equip DL methods with the underlying physics and hence obtaining higher accuracy. This short communication introduces several model-constrained DL approaches (including both feed-forward DNN and autoencoders) that are capable of learning not only information hidden in the training data but also in the underlying mathematical models to solve inverse problems. We present and provide intuitions for our formulations for general nonlinear problems. For linear inverse problems and linear networks, the first order optimality conditions show that our model-constrained DL approaches can learn information encoded in the underlying mathematical models, and thus can produce consistent or equivalent inverse solutions, while naive purely data-based counterparts cannot.
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We consider ill-posed inverse problems where the forward operator $T$ is unknown, and instead we have access to training data consisting of functions $f_i$ and their noisy images $Tf_i$. This is a practically relevant and challenging problem which current methods are able to solve only under strong assumptions on the training set. Here we propose a new method that requires minimal assumptions on the data, and prove reconstruction rates that depend on the number of training points and the noise level. We show that, in the regime of many training data, the method is minimax optimal. The proposed method employs a type of convolutional neural networks (U-nets) and empirical risk minimization in order to fit the unknown operator. In a nutshell, our approach is based on two ideas: the first is to relate U-nets to multiscale decompositions such as wavelets, thereby linking them to the existing theory, and the second is to use the hierarchical structure of U-nets and the low number of parameters of convolutional neural nets to prove entropy bounds that are practically useful. A significant difference with the existing works on neural networks in nonparametric statistics is that we use them to approximate operators and not functions, which we argue is mathematically more natural and technically more convenient.
There are various inverse problems -- including reconstruction problems arising in medical imaging -- where one is often aware of the forward operator that maps variables of interest to the observations. It is therefore natural to ask whether such knowledge of the forward operator can be exploited in deep learning approaches increasingly used to solve inverse problems. In this paper, we provide one such way via an analysis of the generalisation error of deep learning methods applicable to inverse problems. In particular, by building on the algorithmic robustness framework, we offer a generalisation error bound that encapsulates key ingredients associated with the learning problem such as the complexity of the data space, the size of the training set, the Jacobian of the deep neural network and the Jacobian of the composition of the forward operator with the neural network. We then propose a plug-and-play regulariser that leverages the knowledge of the forward map to improve the generalization of the network. We likewise also propose a new method allowing us to tightly upper bound the Lipschitz constants of the relevant functions that is much more computational efficient than existing ones. We demonstrate the efficacy of our model-aware regularised deep learning algorithms against other state-of-the-art approaches on inverse problems involving various sub-sampling operators such as those used in classical compressed sensing setup and accelerated Magnetic Resonance Imaging (MRI).
Recent work in machine learning shows that deep neural networks can be used to solve a wide variety of inverse problems arising in computational imaging. We explore the central prevailing themes of this emerging area and present a taxonomy that can be used to categorize different problems and reconstruction methods. Our taxonomy is organized along two central axes: (1) whether or not a forward model is known and to what extent it is used in training and testing, and (2) whether or not the learning is supervised or unsupervised, i.e., whether or not the training relies on access to matched ground truth image and measurement pairs. We also discuss the trade-offs associated with these different reconstruction approaches, caveats and common failure modes, plus open problems and avenues for future work.
Tensors are widely used to represent multiway arrays of data. The recovery of missing entries in a tensor has been extensively studied, generally under the assumption that entries are missing completely at random (MCAR). However, in most practical settings, observations are missing not at random (MNAR): the probability that a given entry is observed (also called the propensity) may depend on other entries in the tensor or even on the value of the missing entry. In this paper, we study the problem of completing a partially observed tensor with MNAR observations, without prior information about the propensities. To complete the tensor, we assume that both the original tensor and the tensor of propensities have low multilinear rank. The algorithm first estimates the propensities using a convex relaxation and then predicts missing values using a higher-order SVD approach, reweighting the observed tensor by the inverse propensities. We provide finite-sample error bounds on the resulting complete tensor. Numerical experiments demonstrate the effectiveness of our approach.
We introduce novel communication strategies in synchronous distributed Deep Learning consisting of decentralized gradient reduction orchestration and computational graph-aware grouping of gradient tensors. These new techniques produce an optimal overlap between computation and communication and result in near-linear scaling (0.93) of distributed training up to 27,600 NVIDIA V100 GPUs on the Summit Supercomputer. We demonstrate our gradient reduction techniques in the context of training a Fully Convolutional Neural Network to approximate the solution of a longstanding scientific inverse problem in materials imaging. The efficient distributed training on a dataset size of 0.5 PB, produces a model capable of an atomically-accurate reconstruction of materials, and in the process reaching a peak performance of 2.15(4) EFLOPS$_{16}$.
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