Bayesian Inference
Semi-parametric Expert Bayesian Network Learning with Gaussian Processes and Horseshoe Priors
Weng, Yidou, Doshi-Velez, Finale
This paper proposes a model learning Semi-parametric relationships in an Expert Bayesian Network (SEBN) with linear parameter and structure constraints. We use Gaussian Processes and a Horseshoe prior to introduce minimal nonlinear components. To prioritize modifying the expert graph over adding new edges, we optimize differential Horseshoe scales. In real-world datasets with unknown truth, we generate diverse graphs to accommodate user input, addressing identifiability issues and enhancing interpretability. Evaluation on synthetic and UCI Liver Disorders datasets, using metrics like structural Hamming Distance and test likelihood, demonstrates our models outperform state-of-the-art semi-parametric Bayesian Network model.
Distributed Markov Chain Monte Carlo Sampling based on the Alternating Direction Method of Multipliers
Tzikas, Alexandros E., Romao, Licio, Pilanci, Mert, Abate, Alessandro, Kochenderfer, Mykel J.
Many machine learning applications require operating on a spatially distributed dataset. Despite technological advances, privacy considerations and communication constraints may prevent gathering the entire dataset in a central unit. In this paper, we propose a distributed sampling scheme based on the alternating direction method of multipliers, which is commonly used in the optimization literature due to its fast convergence. In contrast to distributed optimization, distributed sampling allows for uncertainty quantification in Bayesian inference tasks. We provide both theoretical guarantees of our algorithm's convergence and experimental evidence of its superiority to the state-of-the-art. For our theoretical results, we use convex optimization tools to establish a fundamental inequality on the generated local sample iterates. This inequality enables us to show convergence of the distribution associated with these iterates to the underlying target distribution in Wasserstein distance. In simulation, we deploy our algorithm on linear and logistic regression tasks and illustrate its fast convergence compared to existing gradient-based methods.
Estimation of partially known Gaussian graphical models with score-based structural priors
Sevilla, Martín, Marques, Antonio García, Segarra, Santiago
We propose a novel algorithm for the support estimation of partially known Gaussian graphical models that incorporates prior information about the underlying graph. In contrast to classical approaches that provide a point estimate based on a maximum likelihood or a maximum a posteriori criterion using (simple) priors on the precision matrix, we consider a prior on the graph and rely on annealed Langevin diffusion to generate samples from the posterior distribution. Since the Langevin sampler requires access to the score function of the underlying graph prior, we use graph neural networks to effectively estimate the score from a graph dataset (either available beforehand or generated from a known distribution). Numerical experiments demonstrate the benefits of our approach.
Particle-MALA and Particle-mGRAD: Gradient-based MCMC methods for high-dimensional state-space models
Corenflos, Adrien, Finke, Axel
State-of-the-art methods for Bayesian inference in state-space models are (a) conditional sequential Monte Carlo (CSMC) algorithms; (b) sophisticated 'classical' MCMC algorithms like MALA, or mGRAD from Titsias and Papaspiliopoulos (2018, arXiv:1610.09641v3 [stat.ML]). The former propose $N$ particles at each time step to exploit the model's 'decorrelation-over-time' property and thus scale favourably with the time horizon, $T$ , but break down if the dimension of the latent states, $D$, is large. The latter leverage gradient-/prior-informed local proposals to scale favourably with $D$ but exhibit sub-optimal scalability with $T$ due to a lack of model-structure exploitation. We introduce methods which combine the strengths of both approaches. The first, Particle-MALA, spreads $N$ particles locally around the current state using gradient information, thus extending MALA to $T > 1$ time steps and $N > 1$ proposals. The second, Particle-mGRAD, additionally incorporates (conditionally) Gaussian prior dynamics into the proposal, thus extending the mGRAD algorithm to $T > 1$ time steps and $N > 1$ proposals. We prove that Particle-mGRAD interpolates between CSMC and Particle-MALA, resolving the 'tuning problem' of choosing between CSMC (superior for highly informative prior dynamics) and Particle-MALA (superior for weakly informative prior dynamics). We similarly extend other 'classical' MCMC approaches like auxiliary MALA, aGRAD, and preconditioned Crank-Nicolson-Langevin (PCNL) to $T > 1$ time steps and $N > 1$ proposals. In experiments, for both highly and weakly informative prior dynamics, our methods substantially improve upon both CSMC and sophisticated 'classical' MCMC approaches.
Discovering group dynamics in synchronous time series via hierarchical recurrent switching-state models
Wojnowicz, Michael, Rath, Preetish, Miller, Eric, Miller, Jeffrey, Hancock, Clifford, O'Donovan, Meghan, Elkin-Frankston, Seth, Brunye, Thaddeus, Hughes, Michael C.
We seek to model a collection of time series arising from multiple entities interacting over the same time period. Recent work focused on modeling individual time series is inadequate for our intended applications, where collective system-level behavior influences the trajectories of individual entities. To address such problems, we present a new hierarchical switching-state model that can be trained in an unsupervised fashion to simultaneously explain both system-level and individual-level dynamics. We employ a latent system-level discrete state Markov chain that drives latent entity-level chains which in turn govern the dynamics of each observed time series. Feedback from the observations to the chains at both the entity and system levels improves flexibility via context-dependent state transitions. Our hierarchical switching recurrent dynamical models can be learned via closed-form variational coordinate ascent updates to all latent chains that scale linearly in the number of individual time series. This is asymptotically no more costly than fitting separate models for each entity. Experiments on synthetic and real datasets show that our model can produce better forecasts of future entity behavior than existing methods. Moreover, the availability of latent state chains at both the entity and system level enables interpretation of group dynamics.
A Nonparametric Bayes Approach to Online Activity Prediction
Beraha, Mario, Masoero, Lorenzo, Favaro, Stefano, Richardson, Thomas S.
Examples include the number of users who will install a software update, the number of customers who will use a new feature on a website or who will participate in an A/B test. Whether the focus is on estimating the number of individuals initiating an action or predicting the temporal span needed to attain a desired user participation threshold, accurate predictive models play a central role in decision making, resource allocation, and enhancing user experiences. See, e.g., Kohavi et al. (2007) and Bakshy et al. (2014) for further details on online experiments. While participation data can be formally treated as a time series, the problem of forecasting user participation does not lend itself to time series models (see Richardson et al., 2022, and the references therein). Moreover, intricate dynamics that underlie user engagement patterns. Conventional models often assume that initiation times are identically distributed, ignoring the diverse behaviors and preferences exhibited by individuals. In reality, users demonstrate varying propensities to engage, leading to a multitude of initiation timelines. Recognizing this complexity, Richardson et al. (2022) recently proposed a Bayesian model for the users' initiation times, which allows different behaviors to be captured, while simultaneously borrowing strength as is typical in hierarchical Bayesian models.
Bayesian Optimization through Gaussian Cox Process Models for Spatio-temporal Data
Mei, Yongsheng, Imani, Mahdi, Lan, Tian
Bayesian optimization (BO) has established itself as a leading strategy for efficiently optimizing expensive-to-evaluate functions. Existing BO methods mostly rely on Gaussian process (GP) surrogate models and are not applicable to (doublystochastic) Gaussian Cox processes, where the observation process is modulated by a latent intensity function modeled as a GP. In this paper, we propose a novel maximum a posteriori inference of Gaussian Cox processes. It leverages the Laplace approximation and change of kernel technique to transform the problem into a new reproducing kernel Hilbert space, where it becomes more tractable computationally. It enables us to obtain both a functional posterior of the latent intensity function and the covariance of the posterior, thus extending existing works that often focus on specific link functions or estimating the posterior mean. Using the result, we propose a BO framework based on the Gaussian Cox process model and further develop a Nyström approximation for efficient computation. Extensive evaluations on various synthetic and real-world datasets demonstrate significant improvement over state-of-the-art inference solutions for Gaussian Cox processes, as well as effective BO with a wide range of acquisition functions designed through the underlying Gaussian Cox process model. Bayesian optimization (BO) has emerged as a prevalent sample-efficient scheme for global optimization of expensive multimodal functions.
Energy-Based Concept Bottleneck Models: Unifying Prediction, Concept Intervention, and Conditional Interpretations
Xu, Xinyue, Qin, Yi, Mi, Lu, Wang, Hao, Li, Xiaomeng
Existing methods, such as concept bottleneck models (CBMs), have been successful in providing concept-based interpretations for black-box deep learning models. They typically work by predicting concepts given the input and then predicting the final class label given the predicted concepts. However, (1) they often fail to capture the high-order, nonlinear interaction between concepts, e.g., correcting a predicted concept (e.g., "yellow breast") does not help correct highly correlated concepts (e.g., "yellow belly"), leading to suboptimal final accuracy; (2) they cannot naturally quantify the complex conditional dependencies between different concepts and class labels (e.g., for an image with the class label "Kentucky Warbler" and a concept "black bill", what is the probability that the model correctly predicts another concept "black crown"), therefore failing to provide deeper insight into how a black-box model works. In response to these limitations, we propose Energy-based Concept Bottleneck Models (ECBMs). Our ECBMs use a set of neural networks to define the joint energy of candidate (input, concept, class) tuples. With such a unified interface, prediction, concept correction, and conditional dependency quantification are then represented as conditional probabilities, which are generated by composing different energy functions. Our ECBMs address both limitations of existing CBMs, providing higher accuracy and richer concept interpretations. Empirical results show that our approach outperforms the state-of-the-art on real-world datasets.
Analyzing Dataset Annotation Quality Management in the Wild
Klie, Jan-Christoph, de Castilho, Richard Eckart, Gurevych, Iryna
Data quality is crucial for training accurate, unbiased, and trustworthy machine learning models as well as for their correct evaluation. Recent works, however, have shown that even popular datasets used to train and evaluate state-of-the-art models contain a non-negligible amount of erroneous annotations, biases, or artifacts. While practices and guidelines regarding dataset creation projects exist, to our knowledge, large-scale analysis has yet to be performed on how quality management is conducted when creating natural language datasets and whether these recommendations are followed. Therefore, we first survey and summarize recommended quality management practices for dataset creation as described in the literature and provide suggestions for applying them. Then, we compile a corpus of 591 scientific publications introducing text datasets and annotate it for quality-related aspects, such as annotator management, agreement, adjudication, or data validation. Using these annotations, we then analyze how quality management is conducted in practice. A majority of the annotated publications apply good or excellent quality management. However, we deem the effort of 30\% of the works as only subpar. Our analysis also shows common errors, especially when using inter-annotator agreement and computing annotation error rates.
Is Temperature Sample Efficient for Softmax Gaussian Mixture of Experts?
Nguyen, Huy, Akbarian, Pedram, Ho, Nhat
Dense-to-sparse gating mixture of experts (MoE) has recently become an effective alternative to a well-known sparse MoE. Rather than fixing the number of activated experts as in the latter model, which could limit the investigation of potential experts, the former model utilizes the temperature to control the softmax weight distribution and the sparsity of the MoE during training in order to stabilize the expert specialization. Nevertheless, while there are previous attempts to theoretically comprehend the sparse MoE, a comprehensive analysis of the dense-to-sparse gating MoE has remained elusive. Therefore, we aim to explore the impacts of the dense-to-sparse gate on the maximum likelihood estimation under the Gaussian MoE in this paper. We demonstrate that due to interactions between the temperature and other model parameters via some partial differential equations, the convergence rates of parameter estimations are slower than any polynomial rates, and could be as slow as $\mathcal{O}(1/\log(n))$, where $n$ denotes the sample size. To address this issue, we propose using a novel activation dense-to-sparse gate, which routes the output of a linear layer to an activation function before delivering them to the softmax function. By imposing linearly independence conditions on the activation function and its derivatives, we show that the parameter estimation rates are significantly improved to polynomial rates.