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Image background features can constitute background bias (spurious correlations) and impact deep classifiers decisions, causing shortcut learning (Clever Hans effect) and reducing the generalization skill on real-world data. The concept of optimizing Layer-wise Relevance Propagation (LRP) heatmaps, to improve classifier behavior, was recently introduced by a neural network architecture named ISNet. It minimizes background relevance in LRP maps, to mitigate the influence of image background features on deep classifiers decisions, hindering shortcut learning and improving generalization. For each training image, the original ISNet produces one heatmap per possible class in the classification task, hence, its training time scales linearly with the number of classes. Here, we introduce reformulated architectures that allow the training time to become independent from this number, rendering the optimization process much faster. We challenged the enhanced models utilizing the MNIST dataset with synthetic background bias, and COVID-19 detection in chest X-rays, an application that is prone to shortcut learning due to background bias. The trained models minimized background attention and hindered shortcut learning, while retaining high accuracy. Considering external (out-of-distribution) test datasets, they consistently proved more accurate than multiple state-of-the-art deep neural network architectures, including a dedicated image semantic segmenter followed by a classifier. The architectures presented here represent a potentially massive improvement in training speed over the original ISNet, thus introducing LRP optimization into a gamut of applications that could not be feasibly handled by the original model.

Lambert's problem concerns with transferring a spacecraft from a given initial to a given terminal position within prescribed flight time via velocity control subject to a gravitational force field. We consider a probabilistic variant of the Lambert problem where the knowledge of the endpoint constraints in position vectors are replaced by the knowledge of their respective joint probability density functions. We show that the Lambert problem with endpoint joint probability density constraints is a generalized optimal mass transport (OMT) problem, thereby connecting this classical astrodynamics problem with a burgeoning area of research in modern stochastic control and stochastic machine learning. This newfound connection allows us to rigorously establish the existence and uniqueness of solution for the probabilistic Lambert problem. The same connection also helps to numerically solve the probabilistic Lambert problem via diffusion regularization, i.e., by leveraging further connection of the OMT with the Schr\"odinger bridge problem (SBP). This also shows that the probabilistic Lambert problem with additive dynamic process noise is in fact a generalized SBP, and can be solved numerically using the so-called Schr\"odinger factors, as we do in this work. We explain how the resulting analysis leads to solving a boundary-coupled system of reaction-diffusion PDEs where the nonlinear gravitational potential appears as the reaction rate. We propose novel algorithms for the same, and present illustrative numerical results. Our analysis and the algorithmic framework are nonparametric, i.e., we make neither statistical (e.g., Gaussian, first few moments, mixture or exponential family, finite dimensionality of the sufficient statistic) nor dynamical (e.g., Taylor series) approximations.

We provide a quantitative assessment of welfare in the classical model of risk-sharing and exchange under uncertainty. We prove three kinds of results. First, that in an equilibrium allocation, the scope for improving individual welfare by a given margin (an $\ve$-improvement) vanishes as the number of states increases. Second, that the scope for a change in aggregate resources that may be distributed to enhance individual welfare by a given margin also vanishes. Equivalently: in an inefficient allocation, for a given level of resource sub-optimality (as measured by the coefficient of resource under-utilization), the possibilities for enhancing welfare by perturbing aggregate resources decrease exponentially to zero with the number of states. Finally, we consider efficient risk-sharing in standard models of uncertainty aversion with multiple priors, and show that, in an inefficient allocation, certain sets of priors shrink with the size of the state space.

Physics-based computer models based on numerical solution of the governing equations generally cannot make rapid predictions, which in turn, limits their applications in the clinic. To address this issue, we developed a physics-informed neural network (PINN) model that encodes the physics of a closed-loop blood circulation system embedding a left ventricle (LV). The PINN model is trained to satisfy a system of ordinary differential equations (ODEs) associated with a lumped parameter description of the circulatory system. The model predictions have a maximum error of less than 5% when compared to those obtained by solving the ODEs numerically. An inverse modeling approach using the PINN model is also developed to rapidly estimate model parameters (in $\sim$ 3 mins) from single-beat LV pressure and volume waveforms. Using synthetic LV pressure and volume waveforms generated by the PINN model with different model parameter values, we show that the inverse modeling approach can recover the corresponding ground truth values, which suggests that the model parameters are unique. The PINN inverse modeling approach is then applied to estimate LV contractility indexed by the end-systolic elastance $E_{es}$ using waveforms acquired from 11 swine models, including waveforms acquired before and after administration of dobutamine (an inotropic agent) in 3 animals. The estimated $E_{es}$ is about 58% to 284% higher for the data associated with dobutamine compared to those without, which implies that this approach can be used to estimate LV contractility using single-beat measurements. The PINN inverse modeling can potentially be used in the clinic to simultaneously estimate LV contractility and other physiological parameters from single-beat measurements.

Higher order artificial neurons whose outputs are computed by applying an activation function to a higher order multinomial function of the inputs have been considered in the past, but did not gain acceptance due to the extra parameters and computational cost. However, higher order neurons have significantly greater learning capabilities since the decision boundaries of higher order neurons can be complex surfaces instead of just hyperplanes. The boundary of a single quadratic neuron can be a general hyper-quadric surface allowing it to learn many nonlinearly separable datasets. Since quadratic forms can be represented by symmetric matrices, only $\frac{n(n+1)}{2}$ additional parameters are needed instead of $n^2$. A quadratic Logistic regression model is first presented. Solutions to the XOR problem with a single quadratic neuron are considered. The complete vectorized equations for both forward and backward propagation in feedforward networks composed of quadratic neurons are derived. A reduced parameter quadratic neural network model with just $ n $ additional parameters per neuron that provides a compromise between learning ability and computational cost is presented. Comparison on benchmark classification datasets are used to demonstrate that a final layer of quadratic neurons enables networks to achieve higher accuracy with significantly fewer hidden layer neurons. In particular this paper shows that any dataset composed of $\mathcal{C}$ bounded clusters can be separated with only a single layer of $\mathcal{C}$ quadratic neurons.

Mesh degeneration is a bottleneck for fluid-structure interaction (FSI) simulations and for shape optimization via the method of mappings. In both cases, an appropriate mesh motion technique is required. The choice is typically based on heuristics, e.g., the solution operators of partial differential equations (PDE), such as the Laplace or biharmonic equation. Especially the latter, which shows good numerical performance for large displacements, is expensive. Moreover, from a continuous perspective, choosing the mesh motion technique is to a certain extent arbitrary and has no influence on the physically relevant quantities. Therefore, we consider approaches inspired by machine learning. We present a hybrid PDE-NN approach, where the neural network (NN) serves as parameterization of a coefficient in a second order nonlinear PDE. We ensure existence of solutions for the nonlinear PDE by the choice of the neural network architecture. Moreover, we present an approach where a neural network corrects the harmonic extension such that the boundary displacement is not changed. In order to avoid technical difficulties in coupling finite element and machine learning software, we work with a splitting of the monolithic FSI system into three smaller subsystems. This allows to solve the mesh motion equation in a separate step. We assess the quality of the learned mesh motion technique by applying it to a FSI benchmark problem. In addition, we discuss generalizability and computational cost of the learned extension operators.

We consider the capacitated clustering problem in general metric spaces where the goal is to identify $k$ clusters and minimize the sum of the radii of the clusters (we call this the Capacitated-$k$-sumRadii problem). We are interested in fixed-parameter tractable (FPT) approximation algorithms where the running time is of the form $f(k) \cdot \text{poly}(n)$, where $f(k)$ can be an exponential function of $k$ and $n$ is the number of points in the input. In the uniform capacity case, Bandyapadhyay et al. recently gave a $4$-approximation algorithm for this problem. Our first result improves this to an FPT $3$-approximation and extends to a constant factor approximation for any $L_p$ norm of the cluster radii. In the general capacities version, Bandyapadhyay et al. gave an FPT $15$-approximation algorithm. We extend their framework to give an FPT $(4 + \sqrt{13})$-approximation algorithm for this problem. Our framework relies on a novel idea of identifying approximations to optimal clusters by carefully pruning points from an initial candidate set of points. This is in contrast to prior results that rely on guessing suitable points and building balls of appropriate radii around them. On the hardness front, we show that assuming the Exponential Time Hypothesis, there is a constant $c > 1$ such that any $c$-approximation algorithm for the non-uniform capacity version of this problem requires running time $2^{\Omega \left(\frac{k}{polylog(k)} \right)}$.

Functional magnetic resonance imaging (fMRI) plays a crucial role in neuroimaging, enabling the exploration of brain activity through complex-valued signals. These signals, composed of magnitude and phase, offer a rich source of information for understanding brain functions. Traditional fMRI analyses have largely focused on magnitude information, often overlooking the potential insights offered by phase data. In this paper, we propose a novel fully Bayesian model designed for analyzing single-subject complex-valued fMRI (cv-fMRI) data. Our model, which we refer to as the CV-M&P model, is distinctive in its comprehensive utilization of both magnitude and phase information in fMRI signals, allowing for independent prediction of different types of activation maps. We incorporate Gaussian Markov random fields (GMRFs) to capture spatial correlations within the data, and employ image partitioning and parallel computation to enhance computational efficiency. Our model is rigorously tested through simulation studies, and then applied to a real dataset from a unilateral finger-tapping experiment. The results demonstrate the model's effectiveness in accurately identifying brain regions activated in response to specific tasks, distinguishing between magnitude and phase activation.

We address the problem of checking the satisfiability of a set of constrained Horn clauses (CHCs) possibly including more than one query. We propose a transformation technique that takes as input a set of CHCs, including a set of queries, and returns as output a new set of CHCs, such that the transformed CHCs are satisfiable if and only if so are the original ones, and the transformed CHCs incorporate in each new query suitable information coming from the other ones so that the CHC satisfiability algorithm is able to exploit the relationships among all queries. We show that our proposed technique is effective on a non trivial benchmark of sets of CHCs that encode many verification problems for programs manipulating algebraic data types such as lists and trees.

While it is nearly effortless for humans to quickly assess the perceptual similarity between two images, the underlying processes are thought to be quite complex. Despite this, the most widely used perceptual metrics today, such as PSNR and SSIM, are simple, shallow functions, and fail to account for many nuances of human perception. Recently, the deep learning community has found that features of the VGG network trained on the ImageNet classification task has been remarkably useful as a training loss for image synthesis. But how perceptual are these so-called "perceptual losses"? What elements are critical for their success? To answer these questions, we introduce a new Full Reference Image Quality Assessment (FR-IQA) dataset of perceptual human judgments, orders of magnitude larger than previous datasets. We systematically evaluate deep features across different architectures and tasks and compare them with classic metrics. We find that deep features outperform all previous metrics by huge margins. More surprisingly, this result is not restricted to ImageNet-trained VGG features, but holds across different deep architectures and levels of supervision (supervised, self-supervised, or even unsupervised). Our results suggest that perceptual similarity is an emergent property shared across deep visual representations.