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We introduce Stochastic Asymptotical Regularization (SAR) methods for the uncertainty quantification of the stable approximate solution of ill-posed linear-operator equations, which are deterministic models for numerous inverse problems in science and engineering. We prove the regularizing properties of SAR with regard to mean-square convergence. We also show that SAR is an optimal-order regularization method for linear ill-posed problems provided that the terminating time of SAR is chosen according to the smoothness of the solution. This result is proven for both a priori and a posteriori stopping rules under general range-type source conditions. Furthermore, some converse results of SAR are verified. Two iterative schemes are developed for the numerical realization of SAR, and the convergence analyses of these two numerical schemes are also provided. A toy example and a real-world problem of biosensor tomography are studied to show the accuracy and the advantages of SAR: compared with the conventional deterministic regularization approaches for deterministic inverse problems, SAR can provide the uncertainty quantification of the quantity of interest, which can in turn be used to reveal and explicate the hidden information about real-world problems, usually obscured by the incomplete mathematical modeling and the ascendence of complex-structured noise.

Imperative programming allows users to implement their deep neural networks (DNNs) easily and has become an essential part of recent deep learning (DL) frameworks. Recently, several systems have been proposed to combine the usability of imperative programming with the optimized performance of symbolic graph execution. Such systems convert imperative Python DL programs to optimized symbolic graphs and execute them. However, they cannot fully support the usability of imperative programming. For example, if an imperative DL program contains a Python feature with no corresponding symbolic representation (e.g., third-party library calls or unsupported dynamic control flows) they fail to execute the program. To overcome this limitation, we propose Terra, an imperative-symbolic co-execution system that can handle any imperative DL programs while achieving the optimized performance of symbolic graph execution. To achieve this, Terra builds a symbolic graph by decoupling DL operations from Python features. Then, Terra conducts the imperative execution to support all Python features, while delegating the decoupled operations to the symbolic execution. We evaluated the performance improvement and coverage of Terra with ten imperative DL programs for several DNN architectures. The results show that Terra can speed up the execution of all ten imperative DL programs, whereas AutoGraph, one of the state-of-the-art systems, fails to execute five of them.

Stochastic gradient descent ascent (SGDA) and its variants have been the workhorse for solving minimax problems. However, in contrast to the well-studied stochastic gradient descent (SGD) with differential privacy (DP) constraints, there is little work on understanding the generalization (utility) of SGDA with DP constraints. In this paper, we use the algorithmic stability approach to establish the generalization (utility) of DP-SGDA in different settings. In particular, for the convex-concave setting, we prove that the DP-SGDA can achieve an optimal utility rate in terms of the weak primal-dual population risk in both smooth and non-smooth cases. To our best knowledge, this is the first-ever-known result for DP-SGDA in the non-smooth case. We further provide its utility analysis in the nonconvex-strongly-concave setting which is the first-ever-known result in terms of the primal population risk. The convergence and generalization results for this nonconvex setting are new even in the non-private setting. Finally, numerical experiments are conducted to demonstrate the effectiveness of DP-SGDA for both convex and nonconvex cases.

This paper concerns the Time-Domain Full Waveform Inversion (FWI) for dispersive and dissipative poroelastic materials. The forward problem is an initial boundary value problem (IBVP) of the poroelastic equations with a memory term; the FWI is formulated as a minimization problem of a least-square misfit function with the (IBVP) as the constraint. In this paper, we derive the adjoint problem of this minimization problem, whose solution can be applied to computed the direction of steepest descent in the iterative process for minimization. The adjoint problem has a similar numerical structure as the forward problem and hence can be solved by the same numerical solver. Because the tracking of the energy evolution plays an important role in the FWI for dissipative and dispersive equations, the energy analysis of the forward system is also carried out in this paper.

Invariant risk minimization (IRM) has recently emerged as a promising alternative for domain generalization. Nevertheless, the loss function is difficult to optimize for nonlinear classifiers and the original optimization objective could fail when pseudo-invariant features and geometric skews exist. Inspired by IRM, in this paper we propose a novel formulation for domain generalization, dubbed invariant information bottleneck (IIB). IIB aims at minimizing invariant risks for nonlinear classifiers and simultaneously mitigating the impact of pseudo-invariant features and geometric skews. Specifically, we first present a novel formulation for invariant causal prediction via mutual information. Then we adopt the variational formulation of the mutual information to develop a tractable loss function for nonlinear classifiers. To overcome the failure modes of IRM, we propose to minimize the mutual information between the inputs and the corresponding representations. IIB significantly outperforms IRM on synthetic datasets, where the pseudo-invariant features and geometric skews occur, showing the effectiveness of proposed formulation in overcoming failure modes of IRM. Furthermore, experiments on DomainBed show that IIB outperforms $13$ baselines by $0.9\%$ on average across $7$ real datasets.

The pairwise interaction paradigm of graph machine learning has predominantly governed the modelling of relational systems. However, graphs alone cannot capture the multi-level interactions present in many complex systems and the expressive power of such schemes was proven to be limited. To overcome these limitations, we propose Message Passing Simplicial Networks (MPSNs), a class of models that perform message passing on simplicial complexes (SCs) - topological objects generalising graphs to higher dimensions. To theoretically analyse the expressivity of our model we introduce a Simplicial Weisfeiler-Lehman (SWL) colouring procedure for distinguishing non-isomorphic SCs. We relate the power of SWL to the problem of distinguishing non-isomorphic graphs and show that SWL and MPSNs are strictly more powerful than the WL test and not less powerful than the 3-WL test. We deepen the analysis by comparing our model with traditional graph neural networks with ReLU activations in terms of the number of linear regions of the functions they can represent. We empirically support our theoretical claims by showing that MPSNs can distinguish challenging strongly regular graphs for which GNNs fail and, when equipped with orientation equivariant layers, they can improve classification accuracy in oriented SCs compared to a GNN baseline. Additionally, we implement a library for message passing on simplicial complexes that we envision to release in due course.

This paper focuses on the expected difference in borrower's repayment when there is a change in the lender's credit decisions. Classical estimators overlook the confounding effects and hence the estimation error can be magnificent. As such, we propose another approach to construct the estimators such that the error can be greatly reduced. The proposed estimators are shown to be unbiased, consistent, and robust through a combination of theoretical analysis and numerical testing. Moreover, we compare the power of estimating the causal quantities between the classical estimators and the proposed estimators. The comparison is tested across a wide range of models, including linear regression models, tree-based models, and neural network-based models, under different simulated datasets that exhibit different levels of causality, different degrees of nonlinearity, and different distributional properties. Most importantly, we apply our approaches to a large observational dataset provided by a global technology firm that operates in both the e-commerce and the lending business. We find that the relative reduction of estimation error is strikingly substantial if the causal effects are accounted for correctly.

Recent work has shown that a variety of semantics emerge in the latent space of Generative Adversarial Networks (GANs) when being trained to synthesize images. However, it is difficult to use these learned semantics for real image editing. A common practice of feeding a real image to a trained GAN generator is to invert it back to a latent code. However, existing inversion methods typically focus on reconstructing the target image by pixel values yet fail to land the inverted code in the semantic domain of the original latent space. As a result, the reconstructed image cannot well support semantic editing through varying the inverted code. To solve this problem, we propose an in-domain GAN inversion approach, which not only faithfully reconstructs the input image but also ensures the inverted code to be semantically meaningful for editing. We first learn a novel domain-guided encoder to project a given image to the native latent space of GANs. We then propose domain-regularized optimization by involving the encoder as a regularizer to fine-tune the code produced by the encoder and better recover the target image. Extensive experiments suggest that our inversion method achieves satisfying real image reconstruction and more importantly facilitates various image editing tasks, significantly outperforming start-of-the-arts.

In recent years, deep learning techniques have been developed to improve the performance of program synthesis from input-output examples. Albeit its significant progress, the programs that can be synthesized by state-of-the-art approaches are still simple in terms of their complexity. In this work, we move a significant step forward along this direction by proposing a new class of challenging tasks in the domain of program synthesis from input-output examples: learning a context-free parser from pairs of input programs and their parse trees. We show that this class of tasks are much more challenging than previously studied tasks, and the test accuracy of existing approaches is almost 0%. We tackle the challenges by developing three novel techniques inspired by three novel observations, which reveal the key ingredients of using deep learning to synthesize a complex program. First, the use of a non-differentiable machine is the key to effectively restrict the search space. Thus our proposed approach learns a neural program operating a domain-specific non-differentiable machine. Second, recursion is the key to achieve generalizability. Thus, we bake-in the notion of recursion in the design of our non-differentiable machine. Third, reinforcement learning is the key to learn how to operate the non-differentiable machine, but it is also hard to train the model effectively with existing reinforcement learning algorithms from a cold boot. We develop a novel two-phase reinforcement learning-based search algorithm to overcome this issue. In our evaluation, we show that using our novel approach, neural parsing programs can be learned to achieve 100% test accuracy on test inputs that are 500x longer than the training samples.

In this paper, we study the optimal convergence rate for distributed convex optimization problems in networks. We model the communication restrictions imposed by the network as a set of affine constraints and provide optimal complexity bounds for four different setups, namely: the function $F(\xb) \triangleq \sum_{i=1}^{m}f_i(\xb)$ is strongly convex and smooth, either strongly convex or smooth or just convex. Our results show that Nesterov's accelerated gradient descent on the dual problem can be executed in a distributed manner and obtains the same optimal rates as in the centralized version of the problem (up to constant or logarithmic factors) with an additional cost related to the spectral gap of the interaction matrix. Finally, we discuss some extensions to the proposed setup such as proximal friendly functions, time-varying graphs, improvement of the condition numbers.