Dwyer Deighan

Md Azharul Islam, Dwyer Deighan, Tarunraj Singha et al.

Reliable neural architecture selection is an open challenge in time-series forecasting under limited, noisy, and heterogeneous data, where standard heuristic architecture design and validation approaches fail to ensure accurate and reliable prediction and generalization. We propose EVIDENT (EVidence-based IDEntification of Neural archiTectures), a framework for architecture selection that integrates Bayesian training, evidence-based ranking, and task-specific validation under uncertainty. The framework explores the candidate architecture pool and identifies the lowest-capacity model that satisfies a prescribed validation criterion. We demonstrate this method using temporal convolutional networks (TCNs) for individualized blood glucose forecasting in type 1 diabetes patients. The results show that EVIDENT systematically rejects both under- and over-parameterized TCN architectures on population-level diabetes data, while identifying models that generalize reliably to unseen patients. When multiple architectures are competitive, the framework further supports plausibility-weighted ensemble predictions that enhance predictive performance. Compared with a random-search baseline, EVIDENT identified smaller architectures with more consistent forecasting performance on unseen patients. These findings establish EVIDENT as a strategy to neural architecture discovery, enabling reliable model selection for high-consequence forecasting in data-limited and heterogeneous settings.

Amol Salunkhe, Dwyer Deighan, Paul Desjardin et al.

Modeling of turbulent combustion system requires modeling the underlying chemistry and the turbulent flow. Solving both systems simultaneously is computationally prohibitive. Instead, given the difference in scales at which the two sub-systems evolve, the two sub-systems are typically (re)solved separately. Popular approaches such as the Flamelet Generated Manifolds (FGM) use a two-step strategy where the governing reaction kinetics are pre-computed and mapped to a low-dimensional manifold, characterized by a few reaction progress variables (model reduction) and the manifold is then ``looked-up'' during the runtime to estimate the high-dimensional system state by the flow system. While existing works have focused on these two steps independently, in this work we show that joint learning of the progress variables and the look--up model, can yield more accurate results. We build on the base formulation and implementation ChemTab to include the dynamically generated Themochemical State Variables (Lower Dimensional Dynamic Source Terms). We discuss the challenges in the implementation of this deep neural network architecture and experimentally demonstrate it's superior performance.

Dwyer Deighan, Jonas A. Actor, Ravi G. Patel

While Fourier-based neural operators are best suited to learning mappings between functions on periodic domains, several works have introduced techniques for incorporating non trivial boundary conditions. However, all previously introduced methods have restrictions that limit their applicability. In this work, we introduce an alternative approach to imposing boundary conditions inspired by volume penalization from numerical methods and Mixture of Experts (MoE) from machine learning. By introducing competing experts, the approach additionally allows for model selection. To demonstrate the method, we combine a spatially conditioned MoE with the Fourier based, Modal Operator Regression for Physics (MOR-Physics) neural operator and recover a nonlinear operator on a disk and quarter disk. Next, we extract a large eddy simulation (LES) model from direct numerical simulation of channel flow and show the domain decomposition provided by our approach. Finally, we train our LES model with Bayesian variational inference and obtain posterior predictive samples of flow far past the DNS simulation time horizon.

Amol Salunkhe, Dwyer Deighan, Paul DesJardin et al.

Modeling of turbulent combustion system requires modeling the underlying chemistry and the turbulent flow. Solving both systems simultaneously is computationally prohibitive. Instead, given the difference in scales at which the two sub-systems evolve, the two sub-systems are typically (re)solved separately. Popular approaches such as the Flamelet Generated Manifolds (FGM) use a two-step strategy where the governing reaction kinetics are pre-computed and mapped to a low-dimensional manifold, characterized by a few reaction progress variables (model reduction) and the manifold is then "looked-up" during the run-time to estimate the high-dimensional system state by the flow system. While existing works have focused on these two steps independently, we show that joint learning of the progress variables and the look-up model, can yield more accurate results. We propose a deep neural network architecture, called ChemTab, customized for the joint learning task and experimentally demonstrate its superiority over existing state-of-the-art methods.

David Berenbaum, Dwyer Deighan, Thomas Marlow et al.

Despite the growing availability of big data in many fields, historical data on socioevironmental phenomena are often not available due to a lack of automated and scalable approaches for collecting, digitizing, and assembling them. We have developed a data-mining method for extracting tabulated, geocoded data from printed directories. While scanning and optical character recognition (OCR) can digitize printed text, these methods alone do not capture the structure of the underlying data. Our pipeline integrates both page layout analysis and OCR to extract tabular, geocoded data from structured text. We demonstrate the utility of this method by applying it to scanned manufacturing registries from Rhode Island that record 41 years of industrial land use. The resulting spatio-temporal data can be used for socioenvironmental analyses of industrialization at a resolution that was not previously possible. In particular, we find strong evidence for the dispersion of manufacturing from the urban core of Providence, the state's capital, along the Interstate 95 corridor to the north and south.