Uncertainty
Data augmentation in Bayesian neural networks and the cold posterior effect
Nabarro, Seth, Ganev, Stoil, Garriga-Alonso, Adriร , Fortuin, Vincent, van der Wilk, Mark, Aitchison, Laurence
Data augmentation is a highly effective approach for improving performance in deep neural networks. The standard view is that it creates an enlarged dataset by adding synthetic data, which raises a problem when combining it with Bayesian inference: how much data are we really conditioning on? This question is particularly relevant to recent observations linking data augmentation to the cold posterior effect. We investigate various principled ways of finding a log-likelihood for augmented datasets. Our approach prescribes augmenting the same underlying image multiple times, both at test and train-time, and averaging either the logits or the predictive probabilities. Empirically, we observe the best performance with averaging probabilities. While there are interactions with the cold posterior effect, neither averaging logits or averaging probabilities eliminates it.
Synthesising Reinforcement Learning Policies through Set-Valued Inductive Rule Learning
Coppens, Youri, Steckelmacher, Denis, Jonker, Catholijn M., Nowรฉ, Ann
Today's advanced Reinforcement Learning algorithms produce black-box policies, that are often difficult to interpret and trust for a person. We introduce a policy distilling algorithm, building on the CN2 rule mining algorithm, that distills the policy into a rule-based decision system. At the core of our approach is the fact that an RL process does not just learn a policy, a mapping from states to actions, but also produces extra meta-information, such as action values indicating the quality of alternative actions. This meta-information can indicate whether more than one action is near-optimal for a certain state. We extend CN2 to make it able to leverage knowledge about equally-good actions to distill the policy into fewer rules, increasing its interpretability by a person. Then, to ensure that the rules explain a valid, non-degenerate policy, we introduce a refinement algorithm that fine-tunes the rules to obtain good performance when executed in the environment. We demonstrate the applicability of our algorithm on the Mario AI benchmark, a complex task that requires modern reinforcement learning algorithms including neural networks. The explanations we produce capture the learned policy in only a few rules, that allow a person to understand what the black-box agent learned.
Quantum Natural Gradient for Variational Bayes
Lopatnikova, Anna, Tran, Minh-Ngoc
Variational Bayes (VB) is a critical method in machine learning and statistics, underpinning the recent success of Bayesian deep learning. The natural gradient is an essential component of efficient VB estimation, but it is prohibitively computationally expensive in high dimensions. We propose a hybrid quantum-classical algorithm to improve the scaling properties of natural gradient computation and make VB a truly computationally efficient method for Bayesian inference in highdimensional settings. The algorithm leverages matrix inversion from the linear systems algorithm by Harrow, Hassidim, and Lloyd [Phys. Rev. Lett. 103, 15 (2009)] (HHL). We demonstrate that the matrix to be inverted is sparse and the classical-quantum-classical handoffs are sufficiently economical to preserve computational efficiency, making the problem of natural gradient for VB an ideal application of HHL. We prove that, under standard conditions, the VB algorithm with quantum natural gradient is guaranteed to converge.
A Deep Variational Approach to Clustering Survival Data
Manduchi, Laura, Marcinkeviฤs, Riฤards, Massi, Michela C., Gotta, Verena, Mรผller, Timothy, Vasella, Flavio, Neidert, Marian C., Pfister, Marc, Vogt, Julia E.
Survival analysis has gained significant attention in the medical domain and has many far-reaching applications. Although a variety of machine learning methods have been introduced for tackling time-to-event prediction in unstructured data with complex dependencies, clustering of survival data remains an under-explored problem. The latter is particularly helpful in discovering patient subpopulations whose survival is regulated by different generative mechanisms, a critical problem in precision medicine. To this end, we introduce a novel probabilistic approach to cluster survival data in a variational deep clustering setting. Our proposed method employs a deep generative model to uncover the underlying distribution of both the explanatory variables and the potentially censored survival times. We compare our model to the related work on survival clustering in comprehensive experiments on a range of synthetic, semi-synthetic, and real-world datasets. Our proposed method performs better at identifying clusters and is competitive at predicting survival times in terms of the concordance index and relative absolute error. To further demonstrate the usefulness of our approach, we show that our method identifies meaningful clusters from an observational cohort of hemodialysis patients that are consistent with previous clinical findings.
Theoretical Modeling of Communication Dynamics
Enรlin, Torsten, Kainz, Viktoria, Bลhm, Cรฉline
Communication is a cornerstone of social interactions, be it with human or artificial intelligence (AI). Yet it can be harmful, depending on the honesty of the exchanged information. To study this, an agent based sociological simulation framework is presented, the reputation game. This illustrates the impact of different communication strategies on the agents' reputation. The game focuses on the trustworthiness of the participating agents, their honesty as perceived by others. In the game, each agent exchanges statements with the others about their own and each other's honesty, which lets their judgments evolve. Various sender and receiver strategies are studied, like sycophant, egocentricity, pathological lying, and aggressiveness for senders as well as awareness and lack thereof for receivers. Minimalist malicious strategies are identified, like being manipulative, dominant, or destructive, which significantly increase reputation at others' costs. Phenomena such as echo chambers, self-deception, deception symbiosis, clique formation, freezing of group opinions emerge from the dynamics. This indicates that the reputation game can be studied for complex group phenomena, to test behavioral hypothesis, and to analyze AI influenced social media. With refined rules it may help to understand social interactions, and to safeguard the design of non-abusive AI systems.
Loss function based second-order Jensen inequality and its application to particle variational inference
Futami, Futoshi, Iwata, Tomoharu, Ueda, Naonori, Sato, Issei, Sugiyama, Masashi
Bayesian model averaging, obtained as the expectation of a likelihood function by a posterior distribution, has been widely used for prediction, evaluation of uncertainty, and model selection. Various approaches have been developed to efficiently capture the information in the posterior distribution; one such approach is the optimization of a set of models simultaneously with interaction to ensure the diversity of the individual models in the same way as ensemble learning. A representative approach is particle variational inference (PVI), which uses an ensemble of models as an empirical approximation for the posterior distribution. PVI iteratively updates each model with a repulsion force to ensure the diversity of the optimized models. However, despite its promising performance, a theoretical understanding of this repulsion and its association with the generalization ability remains unclear. In this paper, we tackle this problem in light of PAC-Bayesian analysis. First, we provide a new second-order Jensen inequality, which has the repulsion term based on the loss function. Thanks to the repulsion term, it is tighter than the standard Jensen inequality. Then, we derive a novel generalization error bound and show that it can be reduced by enhancing the diversity of models. Finally, we derive a new PVI that optimizes the generalization error bound directly. Numerical experiments demonstrate that the performance of the proposed PVI compares favorably with existing methods in the experiment.
A Central Limit Theorem, Loss Aversion and Multi-Armed Bandits
Chen, Zengjing, Epstein, Larry G., Zhang, Guodong
This paper establishes a central limit theorem under the assumption that conditional variances can vary in a largely unstructured history-dependent way across experiments subject only to the restriction that they lie in a fixed interval. Limits take a novel and tractable form, and are expressed in terms of oscillating Brownian motion. A second contribution is application of this result to a class of multi-armed bandit problems where the decision-maker is loss averse.
Lower Bounds on Metropolized Sampling Methods for Well-Conditioned Distributions
Lee, Yin Tat, Shen, Ruoqi, Tian, Kevin
Sampling from a continuous distribution in high dimensions is a fundamental problem in algorithm design. As sampling serves as a key subroutine in a variety of tasks in machine learning [AdFDJ03], statistical methods [RC99], and scientific computing [Liu01], it is an important undertaking to understand the complexity of sampling from families of distributions arising in applications. The more restricted problem of sampling from a particular family of distributions, which we call "well-conditioned distributions," has garnered a substantial amount of recent research effort from the algorithmic learning and statistics communities. This specific family is interesting for a number of reasons. First of all, it is practically relevant: Bayesian methods have found increasing use in machine learning applications [Bar12], and many distributions arising from these methods are wellconditioned, such as multivariate Gaussians, mixture models with small separation, and densities arising from Bayesian logistic regression with a Gaussian prior [DCWY18].
Mode recovery in neural autoregressive sequence modeling
Kulikov, Ilia, Welleck, Sean, Cho, Kyunghyun
Despite its wide use, recent studies have revealed unexpected and undesirable properties of neural autoregressive sequence models trained with maximum likelihood, such as an unreasonably high affinity to short sequences after training and to infinitely long sequences at decoding time. We propose to study these phenomena by investigating how the modes, or local maxima, of a distribution are maintained throughout the full learning chain of the ground-truth, empirical, learned and decoding-induced distributions, via the newly proposed mode recovery cost. We design a tractable testbed where we build three types of ground-truth distributions: (1) an LSTM based structured distribution, (2) an unstructured distribution where probability of a sequence does not depend on its content, and (3) a product of these two which we call a semi-structured distribution. Our study reveals both expected and unexpected findings. First, starting with data collection, mode recovery cost strongly relies on the ground-truth distribution and is most costly with the semi-structured distribution. Second, after learning, mode recovery cost from the ground-truth distribution may increase or decrease compared to data collection, with the largest cost degradation occurring with the semi-structured ground-truth distribution. Finally, the ability of the decoding-induced distribution to recover modes from the learned distribution is highly impacted by the choices made earlier in the learning chain. We conclude that future research must consider the entire learning chain in order to fully understand the potentials and perils and to further improve neural autoregressive sequence models.
Tractable Density Estimation on Learned Manifolds with Conformal Embedding Flows
Ross, Brendan Leigh, Cresswell, Jesse C.
Normalizing flows are generative models that provide tractable density estimation by transforming a simple base distribution into a complex target distribution. However, this technique cannot directly model data supported on an unknown low-dimensional manifold, a common occurrence in real-world domains such as image data. Recent attempts to remedy this limitation have introduced geometric complications that defeat a central benefit of normalizing flows: exact density estimation. We recover this benefit with Conformal Embedding Flows, a framework for designing flows that learn manifolds with tractable densities. We argue that composing a standard flow with a trainable conformal embedding is the most natural way to model manifold-supported data. To this end, we present a series of conformal building blocks and apply them in experiments with real-world and synthetic data to demonstrate that flows can model manifold-supported distributions without sacrificing tractable likelihoods.