Statistical Learning
Subspace Recovery in Winsorized PCA: Insights into Accuracy and Robustness
Han, Sangil, Kim, Kyoowon, Jung, Sungkyu
In this paper, we explore the theoretical properties of subspace recovery using Winsorized Principal Component Analysis (WPCA), utilizing a common data transformation technique that caps extreme values to mitigate the impact of outliers. Despite the widespread use of winsorization in various tasks of multivariate analysis, its theoretical properties, particularly for subspace recovery, have received limited attention. We provide a detailed analysis of the accuracy of WPCA, showing that increasing the number of samples while decreasing the proportion of outliers guarantees the consistency of the sample subspaces from WPCA with respect to the true population subspace. Furthermore, we establish perturbation bounds that ensure the WPCA subspace obtained from contaminated data remains close to the subspace recovered from pure data. Additionally, we extend the classical notion of breakdown points to subspace-valued statistics and derive lower bounds for the breakdown points of WPCA. Our analysis demonstrates that WPCA exhibits strong robustness to outliers while maintaining consistency under mild assumptions. A toy example is provided to numerically illustrate the behavior of the upper bounds for perturbation bounds and breakdown points, emphasizing winsorization's utility in subspace recovery.
Rectifying Conformity Scores for Better Conditional Coverage
Plassier, Vincent, Fishkov, Alexander, Dheur, Victor, Guizani, Mohsen, Taieb, Souhaib Ben, Panov, Maxim, Moulines, Eric
We present a new method for generating confidence sets within the split conformal prediction framework. Our method performs a trainable transformation of any given conformity score to improve conditional coverage while ensuring exact marginal coverage. The transformation is based on an estimate of the conditional quantile of conformity scores. The resulting method is particularly beneficial for constructing adaptive confidence sets in multi-output problems where standard conformal quantile regression approaches have limited applicability. We develop a theoretical bound that captures the influence of the accuracy of the quantile estimate on the approximate conditional validity, unlike classical bounds for conformal prediction methods that only offer marginal coverage. We experimentally show that our method is highly adaptive to the local data structure and outperforms existing methods in terms of conditional coverage, improving the reliability of statistical inference in various applications.
A calibration test for evaluating set-based epistemic uncertainty representations
Jรผrgens, Mira, Mortier, Thomas, Hรผllermeier, Eyke, Bengs, Viktor, Waegeman, Willem
The accurate representation of epistemic uncertainty is a challenging yet essential task in machine learning. A widely used representation corresponds to convex sets of probabilistic predictors, also known as credal sets. One popular way of constructing these credal sets is via ensembling or specialized supervised learning methods, where the epistemic uncertainty can be quantified through measures such as the set size or the disagreement among members. In principle, these sets should contain the true data-generating distribution. As a necessary condition for this validity, we adopt the strongest notion of calibration as a proxy. Concretely, we propose a novel statistical test to determine whether there is a convex combination of the set's predictions that is calibrated in distribution. In contrast to previous methods, our framework allows the convex combination to be instance dependent, recognizing that different ensemble members may be better calibrated in different regions of the input space. Moreover, we learn this combination via proper scoring rules, which inherently optimize for calibration. Building on differentiable, kernel-based estimators of calibration errors, we introduce a nonparametric testing procedure and demonstrate the benefits of capturing instance-level variability on of synthetic and real-world experiments.
PLS-based approach for fair representation learning
De-Diego, Elena M., Perez-Suay, Adriรกn, Gordaliza, Paula, Loubes, Jean-Michel
We revisit the problem of fair representation learning by proposing Fair Partial Least Squares (PLS) components. PLS is widely used in statistics to efficiently reduce the dimension of the data by providing representation tailored for the prediction. We propose a novel method to incorporate fairness constraints in the construction of PLS components. This new algorithm provides a feasible way to construct such features both in the linear and the non linear case using kernel embeddings. The efficiency of our method is evaluated on different datasets, and we prove its superiority with respect to standard fair PCA method.
A Fenchel-Young Loss Approach to Data-Driven Inverse Optimization
Li, Zhehao, Wu, Yanchen, Mao, Xiaojie
Data-driven inverse optimization seeks to estimate unknown parameters in an optimization model from observations of optimization solutions. Many existing methods are ineffective in handling noisy and suboptimal solution observations and also suffer from computational challenges. In this paper, we build a connection between inverse optimization and the Fenchel-Young (FY) loss originally designed for structured prediction, proposing a FY loss approach to data-driven inverse optimization. This new approach is amenable to efficient gradient-based optimization, hence much more efficient than existing methods. We provide theoretical guarantees for the proposed method and use extensive simulation and real-data experiments to demonstrate its significant advantage in parameter estimation accuracy, decision error and computational speed.
Multi-Objective Optimization of Water Resource Allocation for Groundwater Recharge and Surface Runoff Management in Watershed Systems
Sharifi, Abbas, Naeini, Hajar Kazemi, Ahmadi, Mohsen, Asadi, Saeed, Varmaghani, Abbas
Land degradation and air pollution are primarily caused by the salinization of soil and desertification that occurs from the drying of salinity lakes and the release of dust into the atmosphere because of their dried bottom. The complete drying up of a lake has caused a community environmental catastrophe. In this study, we presented an optimization problem to determine the total surface runoff to maintain the level of salinity lake (Urmia Lake). The proposed process has two key stages: identifying the influential factors in determining the lake water level using sensitivity analysis approaches based upon historical data and optimizing the effective variable to stabilize the lake water level under changing design variables. Based upon the Sobol'-Jansen and Morris techniques, the groundwater level and total surface runoff flow are highly effective with nonlinear and interacting impacts of the lake water level. As a result of the sensitivity analysis, we found that it may be possible to effectively manage lake levels by adjusting total surface runoff. We used genetic algorithms, non-linear optimization, and pattern search techniques to solve the optimization problem. Furthermore, the lake level constraint is established based on a pattern as a constant number every month. In order to maintain a consistent pattern of lake levels, it is necessary to increase surface runoff by approximately 8.7 times during filling season. It is necessary to increase this quantity by 33.5 times during the draining season. In the future, the results may serve as a guide for the rehabilitation of the lake.
Contrastive Similarity Learning for Market Forecasting: The ContraSim Framework
Vinden, Nicholas, Saqur, Raeid, Zhu, Zining, Rudzicz, Frank
We introduce the Contrastive Similarity Space Embedding Algorithm (ContraSim), a novel framework for uncovering the global semantic relationships between daily financial headlines and market movements. ContraSim operates in two key stages: (I) Weighted Headline Augmentation, which generates augmented financial headlines along with a semantic fine-grained similarity score, and (II) Weighted Self-Supervised Contrastive Learning (WSSCL), an extended version of classical self-supervised contrastive learning that uses the similarity metric to create a refined weighted embedding space. This embedding space clusters semantically similar headlines together, facilitating deeper market insights. Empirical results demonstrate that integrating ContraSim features into financial forecasting tasks improves classification accuracy from WSJ headlines by 7%. Moreover, leveraging an information density analysis, we find that the similarity spaces constructed by ContraSim intrinsically cluster days with homogeneous market movement directions, indicating that ContraSim captures market dynamics independent of ground truth labels. Additionally, ContraSim enables the identification of historical news days that closely resemble the headlines of the current day, providing analysts with actionable insights to predict market trends by referencing analogous past events.
Exact Recovery of Sparse Binary Vectors from Generalized Linear Measurements
We consider the problem of exact recovery of a $k$-sparse binary vector from generalized linear measurements (such as logistic regression). We analyze the linear estimation algorithm (Plan, Vershynin, Yudovina, 2017), and also show information theoretic lower bounds on the number of required measurements. As a consequence of our results, for noisy one bit quantized linear measurements ($\mathsf{1bCSbinary}$), we obtain a sample complexity of $O((k+\sigma^2)\log{n})$, where $\sigma^2$ is the noise variance. This is shown to be optimal due to the information theoretic lower bound. We also obtain tight sample complexity characterization for logistic regression. Since $\mathsf{1bCSbinary}$ is a strictly harder problem than noisy linear measurements ($\mathsf{SparseLinearReg}$) because of added quantization, the same sample complexity is achievable for $\mathsf{SparseLinearReg}$. While this sample complexity can be obtained via the popular lasso algorithm, linear estimation is computationally more efficient. Our lower bound holds for any set of measurements for $\mathsf{SparseLinearReg}$, (similar bound was known for Gaussian measurement matrices) and is closely matched by the maximum-likelihood upper bound. For $\mathsf{SparseLinearReg}$, it was conjectured in Gamarnik and Zadik, 2017 that there is a statistical-computational gap and the number of measurements should be at least $(2k+\sigma^2)\log{n}$ for efficient algorithms to exist. It is worth noting that our results imply that there is no such statistical-computational gap for $\mathsf{1bCSbinary}$ and logistic regression.
Compression Barriers for Autoregressive Transformers
Haris, Themistoklis, Onak, Krzysztof
A key limitation of autoregressive Transformers is the large memory needed at inference-time to cache all previous key-value (KV) embeddings. Prior works address this by compressing the KV cache, but often assume specific structural properties of the embeddings. This raises the following natural question: Can truly sublinear space utilization be achieved without such assumptions? In this work, we answer this question in the negative. Any algorithm for attention-based token generation must use $\Theta(nd)$ space, where $n$ is the number of tokens generated so far and $d = \Omega(\log n)$ is the dimension of the KV embeddings. Our proof involves a reduction from a classic communication complexity problem and uses a randomized construction that leverages properties of projections in the spirit of the Johnson-Linderstrauss lemma. For the low-dimensional regime $d = o(\log n)$, we show that any algorithm requires $\Omega(d\cdot e^d)$ space and prove, using tight bounds on covering numbers, that SubGen, proposed by Zandieh, Han, Mirrokni and Karbasi, matches this bound. Further, we investigate how sparsity assumptions enable token generation in truly sublinear space, presenting impossibility results and proposing a new KV cache compression algorithm for sliding window attention when the value cache outside the window is unmasked. Finally, we analyze token generation's time complexity, using an indistinguishability argument to prove that no non-adaptive algorithm can compute attention online in sublinear time for all tokens.
Local geometry of high-dimensional mixture models: Effective spectral theory and dynamical transitions
Arous, Gerard Ben, Gheissari, Reza, Huang, Jiaoyang, Jagannath, Aukosh
We study the local geometry of empirical risks in high dimensions via the spectral theory of their Hessian and information matrices. We focus on settings where the data, $(Y_\ell)_{\ell =1}^n\in \mathbb R^d$, are i.i.d. draws of a $k$-component Gaussian mixture model, and the loss depends on the projection of the data into a fixed number of vectors, namely $\mathbf{x}^\top Y$, where $\mathbf{x}\in \mathbb{R}^{d\times C}$ are the parameters, and $C$ need not equal $k$. This setting captures a broad class of problems such as classification by one and two-layer networks and regression on multi-index models. We prove exact formulas for the limits of the empirical spectral distribution and outlier eigenvalues and eigenvectors of such matrices in the proportional asymptotics limit, where the number of samples and dimension $n,d\to\infty$ and $n/d=\phi \in (0,\infty)$. These limits depend on the parameters $\mathbf{x}$ only through the summary statistic of the $(C+k)\times (C+k)$ Gram matrix of the parameters and class means, $\mathbf{G} = (\mathbf{x},\mathbf{\mu})^\top(\mathbf{x},\mathbf{\mu})$. It is known that under general conditions, when $\mathbf{x}$ is trained by stochastic gradient descent, the evolution of these same summary statistics along training converges to the solution of an autonomous system of ODEs, called the effective dynamics. This enables us to connect the spectral theory to the training dynamics. We demonstrate our general results by analyzing the effective spectrum along the effective dynamics in the case of multi-class logistic regression. In this setting, the empirical Hessian and information matrices have substantially different spectra, each with their own static and even dynamical spectral transitions.