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 Learning Graphical Models


Matrix Completion with Hierarchical Graph Side Information

Neural Information Processing Systems

We consider a matrix completion problem that exploits social or item similarity graphs as side information. We develop a universal, parameter-free, and computationally efficient algorithm that starts with hierarchical graph clustering and then iteratively refines estimates both on graph clustering and matrix ratings. Under a hierarchical stochastic block model that well respects practically-relevant social graphs and a low-rank rating matrix model (to be detailed), we demonstrate that our algorithm achieves the information-theoretic limit on the number of observed matrix entries (i.e., optimal sample complexity) that is derived by maximum likelihood estimation together with a lower-bound impossibility result. One consequence of this result is that exploiting the hierarchical structure of social graphs yields a substantial gain in sample complexity relative to the one that simply identifies different groups without resorting to the relational structure across them. We conduct extensive experiments both on synthetic and real-world datasets to corroborate our theoretical results as well as to demonstrate significant performance improvements over other matrix completion algorithms that leverage graph side information.


Beyond MLE: Convex Learning for Text Generation

Neural Information Processing Systems

Maximum likelihood estimation (MLE) is a statistical method used to estimate the parameters of a probability distribution that best explain the observed data. In the context of text generation, MLE is often used to train generative language models, which can then be used to generate new text. However, we argue that MLE is not always necessary and optimal, especially for closed-ended text generation tasks like machine translation. In these tasks, the goal of model is to generate the most appropriate response, which does not necessarily require it to estimate the entire data distribution with MLE. To this end, we propose a novel class of training objectives based on convex functions, which enables text generation models to focus on highly probable outputs without having to estimate the entire data distribution. We investigate the theoretical properties of the optimal predicted distribution when applying convex functions to the loss, demonstrating that convex functions can sharpen the optimal distribution, thereby enabling the model to better capture outputs with high probabilities. Experiments on various text generation tasks and models show the effectiveness of our approach. It enables autoregressive models to bridge the gap between greedy and beam search, and facilitates the learning of non-autoregressive models with a maximum improvement of 9+ BLEU points. Moreover, our approach also exhibits significant impact on large language models (LLMs), substantially enhancing their generative capability on various tasks.


Inverse Optimal Control Adapted to the Noise Characteristics of the Human Sensorimotor System

Neural Information Processing Systems

Computational level explanations based on optimal feedback control with signal-dependent noise have been able to account for a vast array of phenomena in human sensorimotor behavior. However, commonly a cost function needs to be assumed for a task and the optimality of human behavior is evaluated by comparing observed and predicted trajectories. Here, we introduce inverse optimal control with signal-dependent noise, which allows inferring the cost function from observed behavior. To do so, we formalize the problem as a partially observable Markov decision process and distinguish between the agent's and the experimenter's inference problems. Specifically, we derive a probabilistic formulation of the evolution of states and belief states and an approximation to the propagation equation in the linear-quadratic Gaussian problem with signal-dependent noise. We extend the model to the case of partial observability of state variables from the point of view of the experimenter. We show the feasibility of the approach through validation on synthetic data and application to experimental data. Our approach enables recovering the costs and benefits implicit in human sequential sensorimotor behavior, thereby reconciling normative and descriptive approaches in a computational framework.


Distributionally Robust Parametric Maximum Likelihood Estimation

Neural Information Processing Systems

We consider the parameter estimation problem of a probabilistic generative model prescribed using a natural exponential family of distributions. For this problem, the typical maximum likelihood estimator usually overfits under limited training sample size, is sensitive to noise and may perform poorly on downstream predictive tasks. To mitigate these issues, we propose a distributionally robust maximum likelihood estimator that minimizes the worst-case expected log-loss uniformly over a parametric Kullback-Leibler ball around a parametric nominal distribution. Leveraging the analytical expression of the Kullback-Leibler divergence between two distributions in the same natural exponential family, we show that the min-max estimation problem is tractable in a broad setting, including the robust training of generalized linear models. Our novel robust estimator also enjoys statistical consistency and delivers promising empirical results in both regression and classification tasks.


Inverse Rational Control with Partially Observable Continuous Nonlinear Dynamics

Neural Information Processing Systems

A fundamental question in neuroscience is how the brain creates an internal model of the world to guide actions using sequences of ambiguous sensory information. This is naturally formulated as a reinforcement learning problem under partial observations, where an agent must estimate relevant latent variables in the world from its evidence, anticipate possible future states, and choose actions that optimize total expected reward. This problem can be solved by control theory, which allows us to find the optimal actions for a given system dynamics and objective function. However, animals often appear to behave suboptimally.


Near Instance-Optimal PAC Reinforcement Learning for Deterministic MDPs

Neural Information Processing Systems

In probably approximately correct (PAC) reinforcement learning (RL), an agent is required to identify an $\epsilon$-optimal policy with probability $1-\delta$. While minimax optimal algorithms exist for this problem, its instance-dependent complexity remains elusive in episodic Markov decision processes (MDPs). In this paper, we propose the first nearly matching (up to a horizon squared factor and logarithmic terms) upper and lower bounds on the sample complexity of PAC RL in deterministic episodic MDPs with finite state and action spaces. In particular, our bounds feature a new notion of sub-optimality gap for state-action pairs that we call the deterministic return gap. While our instance-dependent lower bound is written as a linear program, our algorithms are very simple and do not require solving such an optimization problem during learning. Their design and analyses employ novel ideas, including graph-theoretical concepts (minimum flows) and a new maximum-coverage exploration strategy.


FlowHMM: Flow-based continuous hidden Markov models

Neural Information Processing Systems

Continuous hidden Markov models (HMMs) assume that observations are generated from a mixture of Gaussian densities, limiting their ability to model more complex distributions. In this work, we address this shortcoming and propose novel continuous HMM models, dubbed FlowHMMs, that enable learning general continuous observation densities without constraining them to follow a Gaussian distribution or their mixtures. To that end, we leverage deep flow-based architectures that model complex, non-Gaussian functions and propose two variants of training a FlowHMM model. The first one, based on gradient-based technique, can be applied directly to continuous multidimensional data, yet its application to larger data sequences remains computationally expensive. Therefore, we also present a second approach to training our FlowHMM that relies on the co-occurrence matrix of discretized observations and considers the joint distribution of pairs of co-observed values, hence rendering the training time independent of the training sequence length. As a result, we obtain a model that can be flexibly adapted to the characteristics and dimensionality of the data. We perform a variety of experiments in which we compare both training strategies with a baseline of Gaussian mixture models. We show, that in terms of quality of the recovered probability distribution, accuracy of prediction of hidden states, and likelihood of unseen data, our approach outperforms the standard Gaussian methods.


FedPop: A Bayesian Approach for Personalised Federated Learning

Neural Information Processing Systems

Personalised federated learning (FL) aims at collaboratively learning a machine learning model tailored for each client. Albeit promising advances have been made in this direction, most of the existing approaches do not allow for uncertainty quantification which is crucial in many applications. In addition, personalisation in the cross-silo and cross-device setting still involves important issues, especially for new clients or those having a small number of observations. This paper aims at filling these gaps. To this end, we propose a novel methodology coined FedPop by recasting personalised FL into the population modeling paradigm where clients' models involve fixed common population parameters and random effects, aiming at explaining data heterogeneity. To derive convergence guarantees for our scheme, we introduce a new class of federated stochastic optimisation algorithms that relies on Markov chain Monte Carlo methods. Compared to existing personalised FL methods, the proposed methodology has important benefits: it is robust to client drift, practical for inference on new clients, and above all, enables uncertainty quantification under mild computational and memory overheads. We provide nonasymptotic convergence guarantees for the proposed algorithms and illustrate their performances on various personalised federated learning tasks.


Empirical Gateaux Derivatives for Causal Inference

Neural Information Processing Systems

We study a constructive procedure that approximates Gateaux derivatives for statistical functionals by finite-differencing, with attention to causal inference functionals. We focus on the case where probability distributions are not known a priori but need also to be estimated from data, leading to empirical Gateaux derivatives, and study relationships between empirical, numerical, and analytical Gateaux derivatives. Starting with a case study of counterfactual mean estimation, we verify the exact relationship between finite-differences and the analytical Gateaux derivative. We then derive requirements on the rates of numerical approximation in perturbation and smoothing that preserve statistical benefits. We study more complicated functionals such as dynamic treatment regimes and the linear-programming formulation for policy optimization infinite-horizon Markov decision processes. In the case of the latter, this approach can be used to approximate bias adjustments in the presence of arbitrary constraints, illustrating the usefulness of constructive approaches for Gateaux derivatives. We find that, omitting unfavorable dimension dependence of smoothing, although rate-double robustness permits for coarser rates of perturbation size than implied by generic approximation analysis of finite-differences for the case of the counterfactual mean, this is not the case for the infinite-horizon MDP policy value.


Nonconvex Sparse Graph Learning under Laplacian Constrained Graphical Model

Neural Information Processing Systems

In this paper, we consider the problem of learning a sparse graph from the Laplacian constrained Gaussian graphical model. This problem can be formulated as a penalized maximum likelihood estimation of the precision matrix under Laplacian structural constraints. Like in the classical graphical lasso problem, recent works made use of the $\ell_1$-norm with the goal of promoting sparsity in the Laplacian constrained precision matrix estimation. However, through empirical evidence, we observe that the $\ell_1$-norm is not effective in imposing a sparse solution in this problem. From a theoretical perspective, we prove that a large regularization parameter will surprisingly lead to a solution representing a fully connected graph instead of a sparse graph. To address this issue, we propose a nonconvex penalized maximum likelihood estimation method, and establish the order of the statistical error. Numerical experiments involving synthetic and real-world data sets demonstrate the effectiveness of the proposed method.