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Analyzing massive spatial datasets using Gaussian process model poses computational challenges. This is a problem prevailing heavily in applications such as environmental modeling, ecology, forestry and environmental heath. We present a novel approximate inference methodology that uses profile likelihood and Krylov subspace methods to estimate the spatial covariance parameters and makes spatial predictions with uncertainty quantification. The proposed method, Kryging, applies for both observations on regular grid and irregularly-spaced observations, and for any Gaussian process with a stationary covariance function, including the popular $\Matern$ covariance family. We make use of the block Toeplitz structure with Toeplitz blocks of the covariance matrix and use fast Fourier transform methods to alleviate the computational and memory bottlenecks. We perform extensive simulation studies to show the effectiveness of our model by varying sample sizes, spatial parameter values and sampling designs. A real data application is also performed on a dataset consisting of land surface temperature readings taken by the MODIS satellite. Compared to existing methods, the proposed method performs satisfactorily with much less computation time and better scalability.

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The estimation of parameter standard errors for semi-variogram models is challenging, given the two-step process required to fit a parametric model to spatially correlated data. Motivated by an application in the social-epidemiology, we focus on exponential semi-variogram models fitted to data between 500 to 2000 observations and little control over the sampling design. Previously proposed methods for the estimation of standard errors cannot be applied in this context. Approximate closed form solutions are too costly using generalized least squares in terms of memory capacities. The generalized bootstrap proposed by Olea and Pardo-Ig\'uzquiza is nonetheless applicable with weighted instead of generalized least squares. However, the standard error estimates are hugely biased and imprecise. Therefore, we propose a filtering method added to the generalized bootstrap. The new development is presented and evaluated with a simulation study which shows that the generalized bootstrap with check-based filtering leads to massively improved results compared to the quantile-based filter method and previously developed approaches. We provide a case study using birthweight data.

Evaluating predictive models is a crucial task in predictive analytics. This process is especially challenging with time series data where the observations show temporal dependencies. Several studies have analysed how different performance estimation methods compare with each other for approximating the true loss incurred by a given forecasting model. However, these studies do not address how the estimators behave for model selection: the ability to select the best solution among a set of alternatives. We address this issue and compare a set of estimation methods for model selection in time series forecasting tasks. We attempt to answer two main questions: (i) how often is the best possible model selected by the estimators; and (ii) what is the performance loss when it does not. We empirically found that the accuracy of the estimators for selecting the best solution is low, and the overall forecasting performance loss associated with the model selection process ranges from 1.2% to 2.3%. We also discovered that some factors, such as the sample size, are important in the relative performance of the estimators.

Subspace recycling iterative methods and other subspace augmentation schemes are a successful extension to Krylov subspace methods in which a Krylov subspace is augmented with a fixed subspace spanned by vectors deemed to be helpful in accelerating convergence or conveying knowledge of the solution. Recently, a survey was published, in which a framework describing the vast majority of such methods was proposed [Soodhalter et al, GAMM-Mitt. 2020]. In many of these methods, the Krylov subspace is one generated by the system matrix composed with a projector that depends on the augmentation space. However, it is not a requirement that a projected Krylov subspace be used. There are augmentation methods built on using Krylov subspaces generated by the original system matrix, and these methods also fit into the general framework. In this note, we observe that one gains implementation benefits by considering such augmentation methods with unprojected Krylov subspaces in the general framework. We demonstrate this by applying the idea to the R$^3$GMRES method proposed in [Dong et al. ETNA 2014] to obtain a simplified implementation and to connect that algorithm to early augmentation schemes based on flexible preconditioning [Saad. SIMAX 1997].

Systems consisting of spheres rolling on elastic membranes have been used as educational tools to introduce a core conceptual idea of General Relativity (GR): how curvature guides the movement of matter. However, previous studies have revealed that such schemes cannot accurately represent relativistic dynamics in the laboratory. Dissipative forces cause the initially GR-like dynamics to be transient and consequently restrict experimental study to only the beginnings of trajectories; dominance of Earth's gravity forbids the difference between spatial and temporal spacetime curvatures. Here by developing a mapping between dynamics of a wheeled vehicle on a spandex membrane, we demonstrate that an active object that can prescribe its speed can not only obtain steady-state orbits, but also use the additional parameters such as speed to tune the orbits towards relativistic dynamics. Our mapping demonstrates how activity mixes space and time in a metric, shows how active particles do not necessarily follow geodesics in the real space but instead follow geodesics in a fiducial spacetime. The mapping further reveals how parameters such as the membrane elasticity and instantaneous speed allow programming a desired spacetime such as the Schwarzschild metric near a non-rotating black hole. Our mapping and framework point the way to the possibility to create a robophysical analog gravity system in the laboratory at low cost and provide insights into active matter in deformable environments and robot exploration in complex landscapes.

Establishing a low-dimensional representation of the data leads to efficient data learning strategies. In many cases, the reduced dimension needs to be explicitly stated and estimated from the data. We explore the estimation of dimension in finite samples as a constrained optimization problem, where the estimated dimension is a maximizer of a penalized profile likelihood criterion within the framework of a probabilistic principal components analysis. Unlike other penalized maximization problems that require an "optimal" penalty tuning parameter, we propose a data-averaging procedure whereby the estimated dimension emerges as the most favourable choice over a range of plausible penalty parameters. The proposed heuristic is compared to a large number of alternative criteria in simulations and an application to gene expression data. Extensive simulation studies reveal that none of the methods uniformly dominate the other and highlight the importance of subject-specific knowledge in choosing statistical methods for dimension learning. Our application results also suggest that gene expression data have a higher intrinsic dimension than previously thought. Overall, our proposed heuristic strikes a good balance and is the method of choice when model assumptions deviated moderately.

Multi-model ensemble analysis integrates information from multiple climate models into a unified projection. However, existing integration approaches based on model averaging can dilute fine-scale spatial information and incur bias from rescaling low-resolution climate models. We propose a statistical approach, called NN-GPR, using Gaussian process regression (GPR) with an infinitely wide deep neural network based covariance function. NN-GPR requires no assumptions about the relationships between models, no interpolation to a common grid, no stationarity assumptions, and automatically downscales as part of its prediction algorithm. Model experiments show that NN-GPR can be highly skillful at surface temperature and precipitation forecasting by preserving geospatial signals at multiple scales and capturing inter-annual variability. Our projections particularly show improved accuracy and uncertainty quantification skill in regions of high variability, which allows us to cheaply assess tail behavior at a 0.44$^\circ$/50 km spatial resolution without a regional climate model (RCM). Evaluations on reanalysis data and SSP245 forced climate models show that NN-GPR produces similar, overall climatologies to the model ensemble while better capturing fine scale spatial patterns. Finally, we compare NN-GPR's regional predictions against two RCMs and show that NN-GPR can rival the performance of RCMs using only global model data as input.

This PhD thesis contains several contributions to the field of statistical causal modeling. Statistical causal models are statistical models embedded with causal assumptions that allow for the inference and reasoning about the behavior of stochastic systems affected by external manipulation (interventions). This thesis contributes to the research areas concerning the estimation of causal effects, causal structure learning, and distributionally robust (out-of-distribution generalizing) prediction methods. We present novel and consistent linear and non-linear causal effects estimators in instrumental variable settings that employ data-dependent mean squared prediction error regularization. Our proposed estimators show, in certain settings, mean squared error improvements compared to both canonical and state-of-the-art estimators. We show that recent research on distributionally robust prediction methods has connections to well-studied estimators from econometrics. This connection leads us to prove that general K-class estimators possess distributional robustness properties. We, furthermore, propose a general framework for distributional robustness with respect to intervention-induced distributions. In this framework, we derive sufficient conditions for the identifiability of distributionally robust prediction methods and present impossibility results that show the necessity of several of these conditions. We present a new structure learning method applicable in additive noise models with directed trees as causal graphs. We prove consistency in a vanishing identifiability setup and provide a method for testing substructure hypotheses with asymptotic family-wise error control that remains valid post-selection. Finally, we present heuristic ideas for learning summary graphs of nonlinear time-series models.

The key issue of few-shot learning is learning to generalize. In this paper, we propose a large margin principle to improve the generalization capacity of metric based methods for few-shot learning. To realize it, we develop a unified framework to learn a more discriminative metric space by augmenting the softmax classification loss function with a large margin distance loss function for training. Extensive experiments on two state-of-the-art few-shot learning models, graph neural networks and prototypical networks, show that our method can improve the performance of existing models substantially with very little computational overhead, demonstrating the effectiveness of the large margin principle and the potential of our method.

Large margin nearest neighbor (LMNN) is a metric learner which optimizes the performance of the popular $k$NN classifier. However, its resulting metric relies on pre-selected target neighbors. In this paper, we address the feasibility of LMNN's optimization constraints regarding these target points, and introduce a mathematical measure to evaluate the size of the feasible region of the optimization problem. We enhance the optimization framework of LMNN by a weighting scheme which prefers data triplets which yield a larger feasible region. This increases the chances to obtain a good metric as the solution of LMNN's problem. We evaluate the performance of the resulting feasibility-based LMNN algorithm using synthetic and real datasets. The empirical results show an improved accuracy for different types of datasets in comparison to regular LMNN.

In this paper we address issues with image retrieval benchmarking on standard and popular Oxford 5k and Paris 6k datasets. In particular, annotation errors, the size of the dataset, and the level of challenge are addressed: new annotation for both datasets is created with an extra attention to the reliability of the ground truth. Three new protocols of varying difficulty are introduced. The protocols allow fair comparison between different methods, including those using a dataset pre-processing stage. For each dataset, 15 new challenging queries are introduced. Finally, a new set of 1M hard, semi-automatically cleaned distractors is selected. An extensive comparison of the state-of-the-art methods is performed on the new benchmark. Different types of methods are evaluated, ranging from local-feature-based to modern CNN based methods. The best results are achieved by taking the best of the two worlds. Most importantly, image retrieval appears far from being solved.

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