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Sebastian Pokutta

Publications and source records attributed to Sebastian Pokutta.

At least 127 records · Page 7Linked to original sources

Interpretability Guarantees with Merlin-Arthur Classifiers

We propose an interactive multi-agent classifier that provides provable interpretability guarantees even for complex agents such as neural networks. These guarantees consist of lower bounds on the mutual information between selected features and the classification decision. Our results are inspired by the Merlin-Arthur protocol from Interactive Proof Systems and express these bounds in terms of measurable metrics such as soundness and completeness. Compared to existing interactive setups, we rely neither on optimal agents nor on the assumption that features are distributed independently. Instead, we use the relative strength of the agents as well as the new concept of Asymmetric Feature Correlation which captures the precise kind of correlations that make interpretability guarantees difficult. We evaluate our results on two small-scale datasets where high mutual information can be verified explicitly.

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Neural Parameter Regression for Explicit Representations of PDE Solution Operators

We introduce Neural Parameter Regression (NPR), a novel framework specifically developed for learning solution operators in Partial Differential Equations (PDEs). Tailored for operator learning, this approach surpasses traditional DeepONets (Lu et al., 2021) by employing Physics-Informed Neural Network (PINN, Raissi et al., 2019) techniques to regress Neural Network (NN) parameters. By parametrizing each solution based on specific initial conditions, it effectively approximates a mapping between function spaces. Our method enhances parameter efficiency by incorporating low-rank matrices, thereby boosting computational efficiency and scalability. The framework shows remarkable adaptability to new initial and boundary conditions, allowing for rapid fine-tuning and inference, even in cases of out-of-distribution examples.

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Convergence and Trade-Offs in Riemannian Gradient Descent and Riemannian Proximal Point

In this work, we analyze two of the most fundamental algorithms in geodesically convex optimization: Riemannian gradient descent and (possibly inexact) Riemannian proximal point. We quantify their rates of convergence and produce different variants with several trade-offs. Crucially, we show the iterates naturally stay in a ball around an optimizer, of radius depending on the initial distance and, in some cases, on the curvature. In contrast, except for limited cases, previous works bounded the maximum distance between iterates and an optimizer only by assumption, leading to incomplete analyses and unquantified rates. We also provide an implementable inexact proximal point algorithm yielding new results on minmax problems, and we prove several new useful properties of Riemannian proximal methods: they work when positive curvature is present, the proximal operator does not move points away from any optimizer, and we quantify the smoothness of its induced Moreau envelope. Further, we explore beyond our theory with empirical tests.

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Conditional Gradients for the Approximate Vanishing Ideal

The vanishing ideal of a set of points $X\subseteq \mathbb{R}^n$ is the set of polynomials that evaluate to $0$ over all points $\mathbf{x} \in X$ and admits an efficient representation by a finite set of polynomials called generators. To accommodate the noise in the data set, we introduce the pairwise conditional gradients approximate vanishing ideal algorithm (PCGAVI) that constructs a set of generators of the approximate vanishing ideal. The constructed generators capture polynomial structures in data and give rise to a feature map that can, for example, be used in combination with a linear classifier for supervised learning. In PCGAVI, we construct the set of generators by solving constrained convex optimization problems with the pairwise conditional gradients algorithm. Thus, PCGAVI not only constructs few but also sparse generators, making the corresponding feature transformation robust and compact. Furthermore, we derive several learning guarantees for PCGAVI that make the algorithm theoretically better motivated than related generator-constructing methods.

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Compression-aware Training of Neural Networks using Frank-Wolfe

Many existing Neural Network pruning approaches rely on either retraining or inducing a strong bias in order to converge to a sparse solution throughout training. A third paradigm, 'compression-aware' training, aims to obtain state-of-the-art dense models that are robust to a wide range of compression ratios using a single dense training run while also avoiding retraining. We propose a framework centered around a versatile family of norm constraints and the Stochastic Frank-Wolfe (SFW) algorithm that encourage convergence to well-performing solutions while inducing robustness towards convolutional filter pruning and low-rank matrix decomposition. Our method is able to outperform existing compression-aware approaches and, in the case of low-rank matrix decomposition, it also requires significantly less computational resources than approaches based on nuclear-norm regularization. Our findings indicate that dynamically adjusting the learning rate of SFW, as suggested by Pokutta et al. (2020), is crucial for convergence and robustness of SFW-trained models and we establish a theoretical foundation for that practice.

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Learning Cuts via Enumeration Oracles

Cutting-planes are one of the most important building blocks for solving large-scale integer programming (IP) problems to (near) optimality. The majority of cutting plane approaches rely on explicit rules to derive valid inequalities that can separate the target point from the feasible set. Local cuts, on the other hand, seek to directly derive the facets of the underlying polyhedron and use them as cutting planes. However, current approaches rely on solving Linear Programming (LP) problems in order to derive such a hyperplane. In this paper, we present a novel generic approach for learning the facets of the underlying polyhedron by accessing it implicitly via an enumeration oracle in a reduced dimension. This is achieved by embedding the oracle in a variant of the Frank-Wolfe algorithm which is capable of generating strong cutting planes, effectively turning the enumeration oracle into a separation oracle. We demonstrate the effectiveness of our approach with a case study targeting the multidimensional knapsack problem (MKP).

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The Four-Color Ramsey Multiplicity of Triangles

We study a generalization of a famous result of Goodman and establish that asymptotically at least a $1/256$ fraction of all triangles needs to be monochromatic in any four-coloring of the edges of a complete graph. We also show that any large enough extremal construction must be based on a blow-up of one of the two $R(3,3,3)$ Ramsey-colorings of $K_{16}$. This result is obtained through an efficient flag algebra formulation by exploiting problem-specific combinatorial symmetries that also allows us to study some related problems.

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Kissing polytopes

We investigate the following question: how close can two disjoint lattice polytopes contained in a fixed hypercube be? This question stems from various contexts where the minimal distance between such polytopes appears in complexity bounds of optimization algorithms. We provide nearly matching lower and upper bounds on this distance and discuss its exact computation. We also give similar bounds in the case of disjoint rational polytopes whose binary encoding length is prescribed.

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The Frank-Wolfe algorithm: a short introduction

In this paper we provide an introduction to the Frank-Wolfe algorithm, a method for smooth convex optimization in the presence of (relatively) complicated constraints. We will present the algorithm, introduce key concepts, and establish important baseline results, such as e.g., primal and dual convergence. We will also discuss some of its properties, present a new adaptive step-size strategy as well as applications.

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Accelerated Methods for Riemannian Min-Max Optimization Ensuring Bounded Geometric Penalties

In this work, we study optimization problems of the form $\min_x \max_y f(x, y)$, where $f(x, y)$ is defined on a product Riemannian manifold $\mathcal{M} \times \mathcal{N}$ and is $μ_x$-strongly geodesically convex (g-convex) in $x$ and $μ_y$-strongly g-concave in $y$, for $μ_x, μ_y \geq 0$. We design accelerated methods when $f$ is $(L_x, L_y, L_{xy})$-smooth and $\mathcal{M}$, $\mathcal{N}$ are Hadamard. To that aim we introduce new g-convex optimization results, of independent interest: we show global linear convergence for metric-projected Riemannian gradient descent and improve existing accelerated methods by reducing geometric constants. Additionally, we complete the analysis of two previous works applying to the Riemannian min-max case by removing an assumption about iterates staying in a pre-specified compact set.

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Acceleration of Frank-Wolfe Algorithms with Open-Loop Step-Sizes

Frank-Wolfe algorithms (FW) are popular first-order methods for solving constrained convex optimization problems that rely on a linear minimization oracle instead of potentially expensive projection-like oracles. Many works have identified accelerated convergence rates under various structural assumptions on the optimization problem and for specific FW variants when using line-search or short-step, requiring feedback from the objective function. Little is known about accelerated convergence regimes when utilizing open-loop step-size rules, a.k.a. FW with pre-determined step-sizes, which are algorithmically extremely simple and stable. Not only is FW with open-loop step-size rules not always subject to the same convergence rate lower bounds as FW with line-search or short-step, but in some specific cases, such as kernel herding in infinite dimensions, it has been empirically observed that FW with open-loop step-size rules enjoys to faster convergence rates than FW with line-search or short-step. We propose a partial answer to this unexplained phenomenon in kernel herding, characterize a general setting for which FW with open-loop step-size rules converges non-asymptotically faster than with line-search or short-step, and derive several accelerated convergence results for FW with open-loop step-size rules. Finally, we demonstrate that FW with open-loop step-sizes can compete with momentum-based open-loop FW variants.

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On a Frank-Wolfe Approach for Abs-smooth Functions

We propose an algorithm which appears to be the first bridge between the fields of conditional gradient methods and abs-smooth optimization. Our problem setting is motivated by various applications that lead to nonsmoothness, such as $\ell_1$ regularization, phase retrieval problems, or ReLU activation in machine learning. To handle the nonsmoothness in our problem, we propose a generalization to the traditional Frank-Wolfe gap and prove that first-order minimality is achieved when it vanishes. We derive a convergence rate for our algorithm which is {\em identical} to the smooth case. Although our algorithm necessitates the solution of a subproblem which is more challenging than the smooth case, we provide an efficient numerical method for its partial solution, and we identify several applications where our approach fully solves the subproblem. Numerical and theoretical convergence is demonstrated, yielding several conjectures.

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Lower Bounds on the Oracle Complexity of Nonsmooth Convex Optimization via Information Theory

We present an information-theoretic approach to lower bound the oracle complexity of nonsmooth black box convex optimization, unifying previous lower bounding techniques by identifying a combinatorial problem, namely string guessing, as a single source of hardness. As a measure of complexity we use distributional oracle complexity, which subsumes randomized oracle complexity as well as worst-case oracle complexity. We obtain strong lower bounds on distributional oracle complexity for the box $[-1,1]^n$, as well as for the $L^p$-ball for $p \geq 1$ (for both low-scale and large-scale regimes), matching worst-case upper bounds, and hence we close the gap between distributional complexity, and in particular, randomized complexity, and worst-case complexity. Furthermore, the bounds remain essentially the same for high-probability and bounded-error oracle complexity, and even for combination of the two, i.e., bounded-error high-probability oracle complexity. This considerably extends the applicability of known bounds.

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The complexity of geometric scaling

Geometric scaling, introduced by Schulz and Weismantel in 2002, solves the integer optimization problem $\max \{c\mathord{\cdot}x: x \in P \cap \mathbb Z^n\}$ by means of primal augmentations, where $P \subset \mathbb R^n$ is a polytope. We restrict ourselves to the important case when $P$ is a $0/1$-polytope. Schulz and Weismantel showed that no more than $O(n \log n \|c\|_\infty)$ calls to an augmentation oracle are required. This upper bound can be improved to $O(n \log \|c\|_\infty)$ using the early-stopping policy proposed in 2018 by Le Bodic, Pavelka, Pfetsch, and Pokutta. Considering both the maximum ratio augmentation variant of the method as well as its approximate version, we show that these upper bounds are essentially tight by maximizing over a $n$-dimensional simplex with vectors $c$ such that $\|c\|_\infty$ is either $n$ or $2^n$.

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Data-driven Distributionally Robust Optimization over Time

Stochastic Optimization (SO) is a classical approach for optimization under uncertainty that typically requires knowledge about the probability distribution of uncertain parameters. As the latter is often unknown, Distributionally Robust Optimization (DRO) provides a strong alternative that determines the best guaranteed solution over a set of distributions (ambiguity set). In this work, we present an approach for DRO over time that uses online learning and scenario observations arriving as a data stream to learn more about the uncertainty. Our robust solutions adapt over time and reduce the cost of protection with shrinking ambiguity. For various kinds of ambiguity sets, the robust solutions converge to the SO solution. Our algorithm achieves the optimization and learning goals without solving the DRO problem exactly at any step. We also provide a regret bound for the quality of the online strategy which converges at a rate of $\mathcal{O}(\log T / \sqrt{T})$, where $T$ is the number of iterations. Furthermore, we illustrate the effectiveness of our procedure by numerical experiments on mixed-integer optimization instances from popular benchmark libraries and give practical examples stemming from telecommunications and routing. Our algorithm is able to solve the DRO over time problem significantly faster than standard reformulations.

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Online Learning for Scheduling MIP Heuristics

Mixed Integer Programming (MIP) is NP-hard, and yet modern solvers often solve large real-world problems within minutes. This success can partially be attributed to heuristics. Since their behavior is highly instance-dependent, relying on hard-coded rules derived from empirical testing on a large heterogeneous corpora of benchmark instances might lead to sub-optimal performance. In this work, we propose an online learning approach that adapts the application of heuristics towards the single instance at hand. We replace the commonly used static heuristic handling with an adaptive framework exploiting past observations about the heuristic's behavior to make future decisions. In particular, we model the problem of controlling Large Neighborhood Search and Diving - two broad and complex classes of heuristics - as a multi-armed bandit problem. Going beyond existing work in the literature, we control two different classes of heuristics simultaneously by a single learning agent. We verify our approach numerically and show consistent node reductions over the MIPLIB 2017 Benchmark set. For harder instances that take at least 1000 seconds to solve, we observe a speedup of 4%.

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Accelerated and Sparse Algorithms for Approximate Personalized PageRank and Beyond

It has recently been shown that ISTA, an unaccelerated optimization method, presents sparse updates for the $\ell_1$-regularized personalized PageRank problem, leading to cheap iteration complexity and providing the same guarantees as the approximate personalized PageRank algorithm (APPR) [FRS+19]. In this work, we design an accelerated optimization algorithm for this problem that also performs sparse updates, providing an affirmative answer to the COLT 2022 open question of [FY22]. Acceleration provides a reduced dependence on the condition number, while the dependence on the sparsity in our updates differs from the ISTA approach. Further, we design another algorithm by using conjugate directions to achieve an exact solution while exploiting sparsity. Both algorithms lead to faster convergence for certain parameter regimes. Our findings apply beyond PageRank and work for any quadratic objective whose Hessian is a positive-definite $M$-matrix.

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How I Learned to Stop Worrying and Love Retraining

Many Neural Network Pruning approaches consist of several iterative training and pruning steps, seemingly losing a significant amount of their performance after pruning and then recovering it in the subsequent retraining phase. Recent works of Renda et al. (2020) and Le & Hua (2021) demonstrate the significance of the learning rate schedule during the retraining phase and propose specific heuristics for choosing such a schedule for IMP (Han et al., 2015). We place these findings in the context of the results of Li et al. (2020) regarding the training of models within a fixed training budget and demonstrate that, consequently, the retraining phase can be massively shortened using a simple linear learning rate schedule. Improving on existing retraining approaches, we additionally propose a method to adaptively select the initial value of the linear schedule. Going a step further, we propose similarly imposing a budget on the initial dense training phase and show that the resulting simple and efficient method is capable of outperforming significantly more complex or heavily parameterized state-of-the-art approaches that attempt to sparsify the network during training. These findings not only advance our understanding of the retraining phase, but more broadly question the belief that one should aim to avoid the need for retraining and reduce the negative effects of 'hard' pruning by incorporating the sparsification process into the standard training.

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