Trading off Consistency and Dimensionality of Convex Surrogates for the Mode

In multiclass classification over $n$ outcomes, the outcomes must be embedded into the reals with dimension at least $n-1$ in order to design a consistent surrogate loss that leads to the "correct" classification, regardless of the data distribution. For large $n$, such as in information retrieval and structured prediction tasks, optimizing a surrogate in $n-1$ dimensions is often intractable. We investigate ways to trade off surrogate loss dimension, the number of problem instances, and restricting the region of consistency in the simplex for multiclass classification. Following past work, we examine an intuitive embedding procedure that maps outcomes into the vertices of convex polytopes in a low-dimensional surrogate space. We show that full-dimensional subsets of the simplex exist around each point mass distribution for which consistency holds, but also, with less than $n-1$ dimensions, there exist distributions for which a phenomenon called hallucination occurs, which is when the optimal report under the surrogate loss is an outcome with zero probability. Looking towards application, we derive a result to check if consistency holds under a given polytope embedding and low-noise assumption, providing insight into when to use a particular embedding. We provide examples of embedding $n = 2^{d}$ outcomes into the $d$-dimensional unit cube and $n = d!$ outcomes into the $d$-dimensional permutahedron under low-noise assumptions. Finally, we demonstrate that with multiple problem instances, we can learn the mode with $\frac{n}{2}$ dimensions over the whole simplex.

Evidential Deep Learning: Enhancing Predictive Uncertainty Estimation for Earth System Science Applications

Robust quantification of predictive uncertainty is critical for understanding factors that drive weather and climate outcomes. Ensembles provide predictive uncertainty estimates and can be decomposed physically, but both physics and machine learning ensembles are computationally expensive. Parametric deep learning can estimate uncertainty with one model by predicting the parameters of a probability distribution but do not account for epistemic uncertainty.. Evidential deep learning, a technique that extends parametric deep learning to higher-order distributions, can account for both aleatoric and epistemic uncertainty with one model. This study compares the uncertainty derived from evidential neural networks to those obtained from ensembles. Through applications of classification of winter precipitation type and regression of surface layer fluxes, we show evidential deep learning models attaining predictive accuracy rivaling standard methods, while robustly quantifying both sources of uncertainty. We evaluate the uncertainty in terms of how well the predictions are calibrated and how well the uncertainty correlates with prediction error. Analyses of uncertainty in the context of the inputs reveal sensitivities to underlying meteorological processes, facilitating interpretation of the models. The conceptual simplicity, interpretability, and computational efficiency of evidential neural networks make them highly extensible, offering a promising approach for reliable and practical uncertainty quantification in Earth system science modeling. In order to encourage broader adoption of evidential deep learning in Earth System Science, we have developed a new Python package, MILES-GUESS (https://github.com/ai2es/miles-guess), that enables users to train and evaluate both evidential and ensemble deep learning.

Proper losses for discrete generative models

We initiate the study of proper losses for evaluating generative models in the discrete setting. Unlike traditional proper losses, we treat both the generative model and the target distribution as black-boxes, only assuming ability to draw i.i.d. samples. We define a loss to be black-box proper if the generative distribution that minimizes expected loss is equal to the target distribution. Using techniques from statistical estimation theory, we give a general construction and characterization of black-box proper losses: they must take a polynomial form, and the number of draws from the model and target distribution must exceed the degree of the polynomial. The characterization rules out a loss whose expectation is the cross-entropy between the target distribution and the model. By extending the construction to arbitrary sampling schemes such as Poisson sampling, however, we show that one can construct such a loss.