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Benjamin Doerr

Publications and source records attributed to Benjamin Doerr.

At least 19 recordsLinked to original sources

A Dynamic Decomposition Strategy for the MOEA/D With Proven Performance Guarantees

The MOEA/D is one of the most successful multi-objective evolutionary algorithms. It operates by decomposing the optimization problem into single-objective subproblems, which are then solved in a co-evolutionary manner. The performance of the MOEA/D depends critically on this decomposition. In this work, we propose a novel way to adjust this decomposition on the fly, for the case of discrete bi-objective optimization. Different from all previous works in this direction, we support our new algorithm with a proven performance guarantee. This is the first work that rigorously proves the runtime of a dynamic multi-objective evolutionary algorithm. For monotonic distortions of the simple LOTZ benchmark, it is known that classic decompositions leave large holes in the Pareto front, making it very hard for the MOEA/D to cover the entire Pareto front. In contrast, we prove that our self-adjusting MOEA/D solves all these LOTZ problems in an expected number of $O(n^4)$ function evaluations. This relatively low runtime as well as the details of our mathematical proof show that the dynamic decomposition strategy indeed evolves a decomposition adjusted to each of these problem instances.

cs.NE↗

Understanding the Co-evolutionary Solution Exchange of the MOEA/D: Already the Smallest Communication Radius Gives the Best-Possible Speed-Up

Besides domination-based algorithms such as the NSGA-II, the decomposition-based MOEA/D is one of the most popular and successful optimization heuristic for multi-objective problems. It decomposes the problem into several, single-objective subproblems. By solving these in a co-evolutionary manner and archiving non-dominated solutions, it approximates or computes the Pareto front. Interestingly, so far no advantages from the co-evolutionary communication of subproblem solutions were proven. In this first mathematical runtime analysis addressing this research question, we investigate how the mutation-based MOEA/D solves the classic OneMinMax benchmark when solutions are exchanged among subproblems in different distances $r$. We show, for the first time, that the MOEA/D profits from an exchange of solutions, and that already very small communication radii $r$ are sufficient to maximally profit from this feature of the algorithm. More precisely, for all values $r \ge 1$ we prove a tight runtime guarantee of $Θ(n^2)$, where $n$ is the problem size. This is asymptotically faster than the known bound of $O(n^2 \log n)$ guarantee for $r=0$, which we complement with a matching bound of $Ω(n^2 \log n)$.

cs.NE↗

A Fresh Look at Lamarckian Evolution and the Baldwin Effect

Baldwinian and Lamarckian evolution have existed for a long time in evolutionary algorithms (EAs) without ever dominating the academic literature or practical applications. In this work, we use modern empirical and theoretical methods to revisit Lamarckian and Baldwinian evolution and rigorously compare them with the generic Darwinian evolution. On the empirical side, we run a comprehensive suite of experiments on graphs from six different datasets from the recent GraphBench benchmark on Maximum Independent Set and Maximum Cut problems. Our results show that Baldwinian and Lamarckian evolution consistently outperform Darwinian evolution, confirming the great potential of local search augmented evolutionary algorithms. Notably, in the great majority of cases, all EAs outperform recent deep learning baselines and approach the performance of highly specialised heuristic and exact solvers. We furthermore report a high-performing set of generalist parameters for all studied evolution types that we hope will be of use to practitioners in future. On the theoretical side, we extend the existing DeceptiveLeadingBlocks benchmark to arbitrary block length $k$. For all constant $k$, we then prove asymptotically tight runtime bounds for the $(1+1)$ EA in the three evolution types on this benchmark. For Baldwinian evolution, these are independent of $k$, whereas for the other two evolution types, the runtimes steeply increase with growing value of $k$.

cs.NE↗

Selection Hyper-heuristics Can Automatically Adjust the Learning Period to Optimally Solve Pseudo-Boolean Problems

The Random Gradient hyper-heuristic was recently shown to be able to learn the optimal neighbourhood size when optimizing the LeadingOnes benchmark via the Randomised Local Search (RLS) meta-heuristic. However, for this to happen, a learning period of a certain length $τ$ had to be used, differently from classic hyper-heuristics, which change their behaviour based on the success of only the previous iteration. In this paper, we show how to automatically set this new parameter value, relieving the user from the non-trivial task of controlling this novel algorithm parameter. We prove that the resulting hyper-heuristic selects the optimal neighbourhood size in a $1-o(1)$ fraction of the iterations and, consequently, optimises the LeadingOnes benchmark in the best possible time (apart from lower-order terms) achievable with these neighborhood sizes.

cs.NE↗

From Understanding Genetic Drift to a Smart-Restart Mechanism for Estimation-of-Distribution Algorithms

Estimation-of-distribution algorithms (EDAs) are optimization algorithms that learn a distribution on the search space from which good solutions can be sampled easily. A key parameter of most EDAs is the sample size (population size). If the population size is too small, the update of the probabilistic model builds on few samples, leading to the undesired effect of genetic drift. Too large population sizes avoid genetic drift, but slow down the process. Building on a recent quantitative analysis of how the population size leads to genetic drift, we design a smart-restart mechanism for EDAs. By stopping runs when the risk for genetic drift is high, it automatically runs the EDA in good parameter regimes. Via a mathematical runtime analysis, we prove a general performance guarantee for this smart-restart scheme. This in particular shows that in many situations where the optimal (problem-specific) parameter values are known, the restart scheme automatically finds these, leading to the asymptotically optimal performance. We also conduct an extensive experimental analysis. On four classic benchmark problems, we clearly observe the critical influence of the population size on the performance, and we find that the smart-restart scheme leads to a performance close to the one obtainable with optimal parameter values. Our results also show that previous theory-based suggestions for the optimal population size can be far from the optimal ones, leading to a performance clearly inferior to the one obtained via the smart-restart scheme. We also conduct experiments with PBIL (cross-entropy algorithm) on two combinatorial optimization problems from the literature, the max-cut problem and the bipartition problem. Again, we observe that the smart-restart mechanism finds much better values for the population size than those suggested in the literature, leading to a much better performance.

cs.NE↗

IMProofBench: Benchmarking AI on Research-Level Mathematical Proof Generation

As the mathematical capabilities of large language models (LLMs) improve, it becomes increasingly important to evaluate their performance on research-level tasks at the frontier of mathematical knowledge. However, existing benchmarks are limited, as they focus solely on final-answer questions or high-school competition problems. To address this gap, we introduce IMProofBench, a private benchmark consisting of 77 peer-reviewed problems developed by expert mathematicians. Each problem requires a detailed proof and is paired with subproblems that have final answers, supporting both an evaluation by human experts and a large-scale quantitative analysis through automated grading. Furthermore, unlike prior benchmarks, the evaluation setup simulates a realistic research environment: models operate in an agentic framework with tools like web search for literature review and mathematical software such as SageMath. Our results show that current LLMs can already solve a significant percentage of research-level questions. IMProofBench will continue to evolve as a dynamic benchmark in collaboration with the mathematical community, ensuring its relevance for evaluating the next generation of LLMs.

cs.CL↗

Speeding Up the NSGA-II via Dynamic Population Sizes

Multi-objective evolutionary algorithms (MOEAs) are among the most widely and successfully applied optimizers for multi-objective problems. However, to store many optimal trade-offs (the Pareto optima) simultaneously, MOEAs are typically run with a large population of solution candidates. This slows down the algorithm and renders the choice of the population size a crucial design decision. In this work, we aim to overcome these difficulties by proposing the dynamic NSGA-II, a variant of the well-known NSGA-II that starts with a small initial population and doubles it after a user-specified number $τ$ of function evaluations, up to a maximum size of $N_{max}$. We prove that the dynamic NSGA-II with optimal parameters computes the Pareto front of the OneMinMax benchmark of size $n$ with high probability in $O(n \log^2 n)$ function evaluations, which is considerably faster than the $Θ(n^2 \log n)$ runtime of the static NSGA-II with optimal parameters. For the OneJumpZeroJump benchmark with gap size $k$, we show a runtime of $O(n^k \log^2 n)$, improving upon the known runtime of $Θ(n^{k+1})$. We also propose a variant that uses the initial population size for a longer period and achieves slightly better performance. Finally, we show that a simple concurrent-run strategy turns our dynamic NSGA-II variants into parameter-less algorithms that exceed the above runtimes only by a logarithmic factor and hence still outperform the static NSGA-II by a factor of $\tildeΩ(n)$.

cs.NE↗

First Mathematical Runtime Analyses of Multi-Objective Evolutionary Algorithms for Multi-Valued Decision Variables

Problems defined on binary decision spaces have been intensively studied in the theory of multi-objective evolutionary algorithms (MOEAs). In contrast, no mathematical runtime analyses exist so far for MOEAs dealing with decision variables that take a finite number $r > 2$ of values, despite the prevalence of such problems in practice. In this work, we begin to fill this research gap. We analyze how the classic SEMO algorithm with unit-strength local mutation computes the Pareto front of an $r$-valued counterpart of the classic \oneminmax benchmark. For the expected number of function evaluations until the Pareto front is covered by the population of this MOEA, we prove an upper bound of $O(n^2 r^2 \log n)$ and a near-tight lower bound of $Ω(n^2 r (r + \log n))$. We can close the small remaining gap between these two bounds by considering a variant of the algorithm that accepts only strictly better solutions; for this variant, we show an upper bound of $O(n^2 r (r + \log n))$, matching our lower bound (which also holds for this variant). Our results suggest that classic MOEAs encounter no significant additional difficulties when dealing with multi-valued decision variables. However, significantly more advanced tools may be required to obtain tight bounds for algorithms with more complex population dynamics.

cs.NE↗

Position: Don't be Afraid of Over-Smoothing And Over-Squashing

Over-smoothing and over-squashing have been extensively studied in the literature on Graph Neural Networks (GNNs) over the past years. We challenge this prevailing focus in GNN research, arguing that these phenomena are less critical for practical applications than assumed. We suggest that performance decreases often stem from uninformative receptive fields rather than over-smoothing. We support this position with extensive experiments on several standard benchmark datasets, demonstrating that accuracy and over-smoothing are mostly uncorrelated and that optimal model depths remain small even with mitigation techniques, thus highlighting the negligible role of over-smoothing. Similarly, we challenge that over-squashing is always detrimental in practical applications. Instead, we posit that the distribution of relevant information over the graph frequently factorises and is often localised within a small k-hop neighbourhood, questioning the necessity of jointly observing entire receptive fields or engaging in an extensive search for long-range interactions. The results of our experiments show that architectural interventions designed to mitigate over-squashing fail to yield significant performance gains. This position paper advocates for a paradigm shift in theoretical research, urging a diligent analysis of learning tasks and datasets using statistics that measure the underlying distribution of label-relevant information to better understand their localisation and factorisation.

stat.ML↗

Improved Runtime Guarantees for the SPEA2 Multi-Objective Optimizer

Together with the NSGA-II, the SPEA2 is one of the most widely used domination-based multi-objective evolutionary algorithms. For both algorithms, the known runtime guarantees are linear in the population size; for the NSGA-II, matching lower bounds exist. With a careful study of the more complex selection mechanism of the SPEA2, we show that it has very different population dynamics. From these, we prove runtime guarantees for the OneMinMax, LeadingOnesTrailingZeros, and OneJumpZeroJump benchmarks that depend less on the population size. For example, we show that the SPEA2 with parent population size $μ\ge n - 2k + 3$ and offspring population size $λ$ computes the Pareto front of the OneJumpZeroJump benchmark with gap size $k$ in an expected number of $O( (λ+μ)n + n^{k+1})$ function evaluations. This shows that the best runtime guarantee of $O(n^{k+1})$ is not only achieved for $μ= Θ(n)$ and $λ= O(n)$ but for arbitrary $μ, λ= O(n^k)$. Thus, choosing suitable parameters -- a key challenge in using heuristic algorithms -- is much easier for the SPEA2 than the NSGA-II.

cs.NE↗

Speeding Up Hyper-Heuristics With Markov-Chain Operator Selection and the Only-Worsening Acceptance Operator

The move-acceptance hyper-heuristic was recently shown to be able to leave local optima with astonishing efficiency (Lissovoi et al., Artificial Intelligence (2023)). In this work, we propose two modifications to this algorithm that demonstrate impressive performances on a large class of benchmarks including the classic Cliff$_d$ and Jump$_m$ function classes. (i) Instead of randomly choosing between the only-improving and any-move acceptance operator, we take this choice via a simple two-state Markov chain. This modification alone reduces the runtime on Jump$_m$ functions with gap parameter $m$ from $Ω(n^{2m-1})$ to $O(n^{m+1})$. (ii) We then replace the all-moves acceptance operator with the operator that only accepts worsenings. Such a, counter-intuitive, operator has not been used before in the literature. However, our proofs show that our only-worsening operator can greatly help in leaving local optima, reducing, e.g., the runtime on Jump functions to $O(n^3 \log n)$ independent of the gap size. In general, we prove a remarkably good runtime of $O(n^{k+1} \log n)$ for our Markov move-acceptance hyper-heuristic on all members of a new benchmark class SEQOPT$_k$, which contains a large number of functions having $k$ successive local optima, and which contains the commonly studied Jump$_m$ and Cliff$_d$ functions for $k=2$.

cs.NE↗

Proven Approximation Guarantees in Multi-Objective Optimization: SPEA2 Beats NSGA-II

Together with the NSGA-II and SMS-EMOA, the strength Pareto evolutionary algorithm 2 (SPEA2) is one of the most prominent dominance-based multi-objective evolutionary algorithms (MOEAs). Different from the NSGA-II, it does not employ the crowding distance (essentially the distance to neighboring solutions) to compare pairwise non-dominating solutions but a complex system of $σ$-distances that builds on the distances to all other solutions. In this work, we give a first mathematical proof showing that this more complex system of distances can be superior. More specifically, we prove that a simple steady-state SPEA2 can compute optimal approximations of the Pareto front of the OneMinMax benchmark in polynomial time. The best proven guarantee for a comparable variant of the NSGA-II only assures approximation ratios of roughly a factor of two, and both mathematical analyses and experiments indicate that optimal approximations are not found efficiently.

cs.NE↗

Near-Tight Runtime Guarantees for Many-Objective Evolutionary Algorithms

Despite significant progress in the field of mathematical runtime analysis of multi-objective evolutionary algorithms (MOEAs), the performance of MOEAs on discrete many-objective problems is little understood. In particular, the few existing performance guarantees for classic MOEAs on classic benchmarks are all roughly quadratic in the size of the Pareto front. In this work, we consider a large class of MOEAs including the (global) SEMO, SMS-EMOA, balanced NSGA-II, NSGA-III, and SPEA2. For these, we prove near-tight runtime guarantees for the four most common benchmark problems OneMinMax, CountingOnesCountingZeros, LeadingOnesTrailingZeros, and OneJumpZeroJump, and this for arbitrary numbers of objectives. Most of our bounds depend only linearly on the size of the largest incomparable set, showing that MOEAs on these benchmarks cope much better with many objectives than what previous works suggested. Most of our bounds are tight apart from small polynomial factors in the number of objectives and length of bitstrings. This is the first time that such tight bounds are proven for many-objective uses of MOEAs. For the runtime of the SEMO on the LOTZ benchmark in $m \ge 6$ objectives, our runtime guarantees are even smaller than the size of the largest incomparable set. This is again the first time that such runtime guarantees are proven.

cs.NE↗

Runtime Analysis of the SMS-EMOA for Many-Objective Optimization

This paper conducts the first rigorous runtime analysis of the SMS-EMOA for many-objective optimization. To this aim, we first propose a many-objective counterpart of the bi-objective OJZJ benchmark. We prove that SMS-EMOA computes the full Pareto front of this benchmark in an expected number of $O(μM n^k)$ iterations, where $n$ denotes the problem size (length of the bit-string representation), $k$ the gap size (a difficulty parameter of the problem), $M=(2n/m-2k+3)^{m/2}$ the size of the Pareto front, and $μ$ the population size (at least the same size as the largest incomparable set). This result together with the existing negative result for the original NSGA-II shows that, in principle, the general approach of the NSGA-II is suitable for many-objective optimization, but the crowding distance as tie-breaker has deficiencies. We obtain three additional insights on the SMS-EMOA. Different from a recent result for the bi-objective \ojzj benchmark, a recently proposed stochastic population update often does not help for its many-objective counterpart. It at most results in a speed-up by a factor of order $2^{k} / μ$, which is $Θ(1)$ for large $m$, such as $m>k$. On the positive side, we prove that heavy-tailed mutation irrespective of the number $m$ of objectives results in a speed-up of order $k^{0.5+k-β}/e^k$. Finally, we conduct the first runtime analyses of the SMS-EMOA on the classic OMM and LOTZ and show that the SMS-EMOA has a performance comparable to the GSEMO and the NSGA-II. Our main technical insight, a general condition ensuring that the SMS-EMOA does not lose Pareto-optimal objective values, promises to be useful also in other runtime analyses of this algorithm.

cs.NE↗

HIEGNet: A Heterogenous Graph Neural Network Including the Immune Environment in Glomeruli Classification

Graph Neural Networks (GNNs) have recently been found to excel in histopathology. However, an important histopathological task, where GNNs have not been extensively explored, is the classification of glomeruli health as an important indicator in nephropathology. This task presents unique difficulties, particularly for the graph construction, i.e., the identification of nodes, edges, and informative features. In this work, we propose a pipeline composed of different traditional and machine learning-based computer vision techniques to identify nodes, edges, and their corresponding features to form a heterogeneous graph. We then proceed to propose a novel heterogeneous GNN architecture for glomeruli classification, called HIEGNet, that integrates both glomeruli and their surrounding immune cells. Hence, HIEGNet is able to consider the immune environment of each glomerulus in its classification. Our HIEGNet was trained and tested on a dataset of Whole Slide Images from kidney transplant patients. Experimental results demonstrate that HIEGNet outperforms several baseline models and generalises best between patients among all baseline models. Our implementation is publicly available at https://github.com/nklsKrmnn/HIEGNet.git.

cs.LG↗

Evolutionary Algorithms Are Significantly More Robust to Noise When They Ignore It

Randomized search heuristics (RSHs) are known to have a certain robustness to noise. Mathematical analyses trying to quantify rigorously how robust RSHs are to a noisy access to the objective function typically assume that each solution is re-evaluated whenever it is compared to others. This aims at preventing that a single noisy evaluation has a lasting negative effect, but is computationally expensive and requires the user to foresee that noise is present (as in a noise-free setting, one would never re-evaluate solutions). In this work, we conduct the first mathematical runtime analysis of an evolutionary algorithm solving a single-objective noisy problem without re-evaluations. We prove that the $(1+1)$ evolutionary algorithm without re-evaluations can optimize the classic LeadingOnes benchmark with up to constant noise rates, in sharp contrast to the version with re-evaluations, where only noise with rates $O(n^{-2} \log n)$ can be tolerated. This result suggests that re-evaluations are much less needed than what was previously thought, and that they actually can be highly detrimental. The insights from our mathematical proofs indicate that this similar results are plausible for other classic benchmarks.

cs.NE↗

Scalable Speed-ups for the SMS-EMOA from a Simple Aging Strategy

Different from single-objective evolutionary algorithms, where non-elitism is an established concept, multi-objective evolutionary algorithms almost always select the next population in a greedy fashion. In the only notable exception, Bian, Zhou, Li, and Qian (IJCAI 2023) proposed a stochastic selection mechanism for the SMS-EMOA and proved that it can speed up computing the Pareto front of the bi-objective jump benchmark with problem size $n$ and gap parameter $k$ by a factor of $\max\{1,2^{k/4}/n\}$. While this constitutes the first proven speed-up from non-elitist selection, suggesting a very interesting research direction, it has to be noted that a true speed-up only occurs for $k \ge 4\log_2(n)$, where the runtime is super-polynomial, and that the advantage reduces for larger numbers of objectives as shown in a later work. In this work, we propose a different non-elitist selection mechanism based on aging, which exempts individuals younger than a certain age from a possible removal. This remedies the two shortcomings of stochastic selection: We prove a speed-up by a factor of $\max\{1,Θ(k)^{k-1}\}$, regardless of the number of objectives. In particular, a positive speed-up can already be observed for constant $k$, the only setting for which polynomial runtimes can be witnessed. Overall, this result supports the use of non-elitist selection schemes, but suggests that aging-based mechanisms can be considerably more powerful than stochastic selection mechanisms.

cs.NE↗

Tight Runtime Guarantees From Understanding the Population Dynamics of the GSEMO Multi-Objective Evolutionary Algorithm

The global simple evolutionary multi-objective optimizer (GSEMO) is a simple, yet often effective multi-objective evolutionary algorithm (MOEA). By only maintaining non-dominated solutions, it has a variable population size that automatically adjusts to the needs of the optimization process. The downside of the dynamic population size is that the population dynamics of this algorithm are harder to understand, resulting, e.g., in the fact that only sporadic tight runtime analyses exist. In this work, we significantly enhance our understanding of the dynamics of the GSEMO, in particular, for the classic CountingOnesCountingZeros (COCZ) benchmark. From this, we prove a lower bound of order $Ω(n^2 \log n)$, for the first time matching the seminal upper bounds known for over twenty years. We also show that the GSEMO finds any constant fraction of the Pareto front in time $O(n^2)$, improving over the previous estimate of $O(n^2 \log n)$ for the time to find the first Pareto optimum. Our methods extend to other classic benchmarks and yield, e.g., the first $Ω(n^{k+1})$ lower bound for the OJZJ benchmark in the case that the gap parameter is $k \in \{2,3\}$. We are therefore optimistic that our new methods will be useful in future mathematical analyses of MOEAs.

cs.NE↗