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We develop information-geometric techniques to analyze the trajectories of the predictions of deep networks during training. By examining the underlying high-dimensional probabilistic models, we reveal that the training process explores an…
Some novel strategies have recently been proposed for single hidden layer neural network training that set randomly the weights from input to hidden layer, while weights from hidden to output layer are analytically determined by…
By adopting a perspective informed by contemporary liquid state theory, we consider how to train an artificial neural network potential to describe inhomogeneous, disordered systems. We find that neural network potentials based on local…
Microstructural evolution is a key aspect of understanding and exploiting the structure-property-performance relation of materials. Modeling microstructure evolution usually relies on coarse-grained simulations with evolution principles…
The largely successful method of training neural networks is to learn their weights using some variant of stochastic gradient descent (SGD). Here, we show that the solutions found by SGD can be further improved by ensembling a subset of the…
Understanding the dynamics of neural networks in different width regimes is crucial for improving their training and performance. We present an exact solution for the learning dynamics of a one-hidden-layer linear network, with…
This paper investigates locally linear regression for locally stationary time series and develops theoretical results for locally linear smoothing and transfer learning. Existing analyses have focused on local constant estimators and given…
Convolutional Neural Networks (CNN) possess many positive qualities when it comes to spatial raster data. Translation invariance enables CNNs to detect features regardless of their position in the scene. However, in some domains, like…
Deep learning optimization exhibits structure that is not captured by worst-case gradient bounds. Empirically, gradients along training trajectories are often temporally predictable and evolve within a low-dimensional subspace. In this work…
Despite the phenomenal success of deep learning in recent years, there remains a gap in understanding the fundamental mechanics of neural nets. More research is focussed on handcrafting complex and larger networks, and the design decisions…
Deepening and widening convolutional neural networks (CNNs) significantly increases the number of trainable weight parameters by adding more convolutional layers and feature maps per layer, respectively. By imposing inter- and intra-group…
Explaining the output of a complicated machine learning model like a deep neural network (DNN) is a central challenge in machine learning. Several proposed local explanation methods address this issue by identifying what dimensions of a…
Recurrent Neural Networks (RNNs) are frequently used to model aspects of brain function and structure. In this work, we trained small fully-connected RNNs to perform temporal and flow control tasks with time-varying stimuli. Our results…
Inner product-based convolution has been the founding stone of convolutional neural networks (CNNs), enabling end-to-end learning of visual representation. By generalizing inner product with a bilinear matrix, we propose the neural…
We explore a new approach for training neural networks where all loss functions are replaced by hard constraints. The same approach is very successful in phase retrieval, where signals are reconstructed from magnitude constraints and…
Inspired by measurement incompatibility and Bell-family inequalities in quantum mechanics, we propose the Non-Classical Network (NCnet), a simple classical neural architecture that stably exhibits non-classical statistical behaviors under…
Convolutional neural networks perform a local and translationally-invariant treatment of the data: quantifying which of these two aspects is central to their success remains a challenge. We study this problem within a teacher-student…
Simulation-based inference techniques are indispensable for parameter estimation of mechanistic and simulable models with intractable likelihoods. While traditional statistical approaches like approximate Bayesian computation and Bayesian…
Self-delimiting (SLIM) programs are a central concept of theoretical computer science, particularly algorithmic information & probability theory, and asymptotically optimal program search (AOPS). To apply AOPS to (possibly recurrent) neural…
Deep Neural Networks inherit spurious correlations embedded in training data and hence may fail to predict desired labels on unseen domains (or environments), which have different distributions from the domain used in training. Invariance…