The star-shaped space of solutions of the spherical negative perceptron

Empirical studies on the landscape of neural networks have shown that low-energy configurations are often found in complex connected structures, where zero-energy paths between pairs of distant solutions can be constructed. Here we consider the spherical negative perceptron, a prototypical non-convex neural network model framed as a continuous constraint satisfaction problem. We introduce a general analytical method for computing energy barriers in the simplex with vertex configurations sampled from the equilibrium. We find that in the over-parameterized regime the solution manifold displays simple connectivity properties. There exists a large geodesically convex component that is attractive for a wide range of optimization dynamics. Inside this region we identify a subset of atypically robust solutions that are geodesically connected with most other solutions, giving rise to a star-shaped geometry. We analytically characterize the organization of the connected space of solutions and show numerical evidence of a transition, at larger constraint densities, where the aforementioned simple geodesic connectivity breaks down.

The Hidden-Manifold Hopfield Model and a learning phase transition

The Hopfield model has a long-standing tradition in statistical physics, being one of the few neural networks for which a theory is available. Extending the theory of Hopfield models for correlated data could help understand the success of deep neural networks, for instance describing how they extract features from data. Motivated by this, we propose and investigate a generalized Hopfield model that we name Hidden-Manifold Hopfield Model: we generate the couplings from $P=\alpha N$ examples with the Hebb rule using a non-linear transformation of $D=\alpha_D N$ random vectors that we call factors, with $N$ the number of neurons. Using the replica method, we obtain a phase diagram for the model that shows a phase transition where the factors hidden in the examples become attractors of the dynamics; this phase exists above a critical value of $\alpha$ and below a critical value of $\alpha_D$. We call this behaviour learning transition.

Noise-cleaning the precision matrix of fMRI time series

We present a comparison between various algorithms of inference of covariance and precision matrices in small datasets of real vectors, of the typical length and dimension of human brain activity time series retrieved by functional Magnetic Resonance Imaging (fMRI). Assuming a Gaussian model underlying the neural activity, the problem consists in denoising the empirically observed matrices in order to obtain a better estimator of the true precision and covariance matrices. We consider several standard noise-cleaning algorithms and compare them on two types of datasets. The first type are time series of fMRI brain activity of human subjects at rest. The second type are synthetic time series sampled from a generative Gaussian model of which we can vary the fraction of dimensions per sample q = N/T and the strength of off-diagonal correlations. The reliability of each algorithm is assessed in terms of test-set likelihood and, in the case of synthetic data, of the distance from the true precision matrix. We observe that the so called Optimal Rotationally Invariant Estimator, based on Random Matrix Theory, leads to a significantly lower distance from the true precision matrix in synthetic data, and higher test likelihood in natural fMRI data. We propose a variant of the Optimal Rotationally Invariant Estimator in which one of its parameters is optimised by cross-validation. In the severe undersampling regime (large q) typical of fMRI series, it outperforms all the other estimators. We furthermore propose a simple algorithm based on an iterative likelihood gradient ascent, providing an accurate estimation for weakly correlated datasets.

Deep learning via message passing algorithms based on belief propagation

Message-passing algorithms based on the Belief Propagation (BP) equations constitute a well-known distributed computational scheme. It is exact on tree-like graphical models and has also proven to be effective in many problems defined on graphs with loops (from inference to optimization, from signal processing to clustering). The BP-based scheme is fundamentally different from stochastic gradient descent (SGD), on which the current success of deep networks is based. In this paper, we present and adapt to mini-batch training on GPUs a family of BP-based message-passing algorithms with a reinforcement field that biases distributions towards locally entropic solutions. These algorithms are capable of training multi-layer neural networks with discrete weights and activations with performance comparable to SGD-inspired heuristics (BinaryNet) and are naturally well-adapted to continual learning. Furthermore, using these algorithms to estimate the marginals of the weights allows us to make approximate Bayesian predictions that have higher accuracy than point-wise solutions.

Reconstruction of Pairwise Interactions using Energy-Based Models

Pairwise models like the Ising model or the generalized Potts model have found many successful applications in fields like physics, biology, and economics. Closely connected is the problem of inverse statistical mechanics, where the goal is to infer the parameters of such models given observed data. An open problem in this field is the question of how to train these models in the case where the data contain additional higher-order interactions that are not present in the pairwise model. In this work, we propose an approach based on Energy-Based Models and pseudolikelihood maximization to address these complications: we show that hybrid models, which combine a pairwise model and a neural network, can lead to significant improvements in the reconstruction of pairwise interactions. We show these improvements to hold consistently when compared to a standard approach using only the pairwise model and to an approach using only a neural network. This is in line with the general idea that simple interpretable models and complex black-box models are not necessarily a dichotomy: interpolating these two classes of models can allow to keep some advantages of both.

Entropic gradient descent algorithms and wide flat minima

The properties of flat minima in the empirical risk landscape of neural networks have been debated for some time. Increasing evidence suggests they possess better generalization capabilities with respect to sharp ones. First, we discuss Gaussian mixture classification models and show analytically that there exist Bayes optimal pointwise estimators which correspond to minimizers belonging to wide flat regions. These estimators can be found by applying maximum flatness algorithms either directly on the classifier (which is norm independent) or on the differentiable loss function used in learning. Next, we extend the analysis to the deep learning scenario by extensive numerical validations. Using two algorithms, Entropy-SGD and Replicated-SGD, that explicitly include in the optimization objective a non-local flatness measure known as local entropy, we consistently improve the generalization error for common architectures (e.g. ResNet, EfficientNet). An easy to compute flatness measure shows a clear correlation with test accuracy.

Clustering of solutions in the symmetric binary perceptron

The geometrical features of the (non-convex) loss landscape of neural network models are crucial in ensuring successful optimization and, most importantly, the capability to generalize well. While minimizers' flatness consistently correlates with good generalization, there has been little rigorous work in exploring the condition of existence of such minimizers, even in toy models. Here we consider a simple neural network model, the symmetric perceptron, with binary weights. Phrasing the learning problem as a constraint satisfaction problem, the analogous of a flat minimizer becomes a large and dense cluster of solutions, while the narrowest minimizers are isolated solutions. We perform the first steps toward the rigorous proof of the existence of a dense cluster in certain regimes of the parameters, by computing the first and second moment upper bounds for the existence of pairs of arbitrarily close solutions. Moreover, we present a non rigorous derivation of the same bounds for sets of $y$ solutions at fixed pairwise distances.

Generalized Approximate Survey Propagation for High-Dimensional Estimation

In Generalized Linear Estimation (GLE) problems, we seek to estimate a signal that is observed through a linear transform followed by a component-wise, possibly nonlinear and noisy, channel. In the Bayesian optimal setting, Generalized Approximate Message Passing (GAMP) is known to achieve optimal performance for GLE. However, its performance can significantly degrade whenever there is a mismatch between the assumed and the true generative model, a situation frequently encountered in practice. In this paper, we propose a new algorithm, named Generalized Approximate Survey Propagation (GASP), for solving GLE in the presence of prior or model mis-specifications. As a prototypical example, we consider the phase retrieval problem, where we show that GASP outperforms the corresponding GAMP, reducing the reconstruction threshold and, for certain choices of its parameters, approaching Bayesian optimal performance. Furthermore, we present a set of State Evolution equations that exactly characterize the dynamics of GASP in the high-dimensional limit.

Signal propagation in continuous approximations of binary neural networks

The training of stochastic neural network models with binary ($\pm1$) weights and activations via a deterministic and continuous surrogate network is investigated. We derive, using mean field theory, a set of scalar equations describing how input signals propagate through the surrogate network. The equations reveal that these continuous models exhibit an order to chaos transition, and the presence of depth scales that limit the maximum trainable depth. Moreover, we predict theoretically and confirm numerically, that common weight initialization schemes used in standard continuous networks, when applied to the mean values of the stochastic binary weights, yield poor training performance. This study shows that, contrary to common intuition, the means of the stochastic binary weights should be initialised close to $\pm 1$ for deeper networks to be trainable.

On the role of synaptic stochasticity in training low-precision neural networks

Stochasticity and limited precision of synaptic weights in neural network models are key aspects of both biological and hardware modeling of learning processes. Here we show that a neural network model with stochastic binary weights naturally gives prominence to exponentially rare dense regions of solutions with a number of desirable properties such as robustness and good generalization performance, while typical solutions are isolated and hard to find. Binary solutions of the standard perceptron problem are obtained from a simple gradient descent procedure on a set of real values parametrizing a probability distribution over the binary synapses. Both analytical and numerical results are presented. An algorithmic extension aimed at training discrete deep neural networks is also investigated.