arXiv subjects

Marius Lindauer

Publications and source records attributed to Marius Lindauer.

At least 19 recordsLinked to original sources

arXiv2026

Dynamic Priors in Bayesian Optimization for Hyperparameter Optimization

Bayesian optimization (BO) is a widely used approach to hyperparameter optimization (HPO). However, most existing HPO methods only incorporate expert knowledge during initialization, limiting practitioners' ability to influence the optimization process as new insights emerge. This limits the applicability of BO in iterative machine learning development workflows. We propose DynaBO, a BO framework that enables continuous user control of the optimization process. Over time, DynaBO leverages provided user priors by augmenting the acquisition function with decaying, prior-weighted preferences while preserving asymptotic convergence guarantees. To enhance robustness, we introduce a surrogate-model-based safeguard that detects and, possibly, rejects misleading priors. We prove theoretical results on near-certain convergence, robustness to deceptive priors, and accelerated convergence when informative priors are provided. Extensive experiments across various HPO benchmarks show that DynaBO consistently outperforms state-of-the-art competitors across all benchmarks and for all prior kinds. Our results demonstrate that DynaBO enables reliable and efficient collaborative BO, bridging automated and manually controlled model development.

cs.LG↗

arXiv2026

Efficient Heteroscedastic Bayesian Optimization for Risk-Aware AutoRL

Reinforcement learning (RL) has shown remarkable success across a wide range of complex tasks. However, RL outcomes can be highly stochastic, and both expected performance and variability often depend on hyperparameter (HP) configurations. We propose efficient and risk-averse heteroscedastic Bayesian Optimization (ERAHBO), a Bayesian optimization method that models both the mean and variance of learning outcomes as functions of the HP configurations. ERAHBO aims to identify HP configurations that achieve high average return while reducing variability across training runs, and it improves the sample efficiency of the HP optimization via adaptive re-sampling rather than a fixed budget per HP. Empirical evaluations across diverse RL algorithms and environments demonstrate that ERAHBO generally outperforms both risk-neutral and risk-averse baselines, delivering improved sample efficiency for risk-averse returns.

cs.LG↗

arXiv2026

Beyond Success Rates: Trainability and Extractability for Offline GCRL

Offline goal-conditioned reinforcement learning (GCRL) is typically benchmarked by the best tuned success rate of each method. This score measures attainable performance, but it does not reveal how reliably a learned goal-conditioned signal can be extracted into a policy: a method could succeed across many value-learning and extraction settings, or only at a narrow, hard-to-find configuration. We study this gap across four methods, GCIQL, GCIVL, QRL, and CRL, under a shared advantage-weighted regression (AWR) extractor. For each method, we construct trainability landscapes over the optimizer learning rate, which affects value learning and actor optimization, and AWR temperature, which controls how selectively the actor imitates high-advantage transitions. Across AntMaze, Cube, and Scene, we observe distinct regimes: high-scoring methods may be broadly accessible or brittle, while broad relative basins may still sit below low absolute ceilings. To interpret these differences, we pair landscapes with post-hoc diagnostics of future-vs-random goal discrimination and AWR weight concentration. Their relationship to downstream success is task-dependent. On AntMaze, where future goals align with path-like progress, these diagnostics explain landscape regimes. On Cube and Scene, goal ranking and manipulation control decouple: methods can rank goals well while failing downstream, or succeed through action-conditioned advantages despite weak future-vs-random separation. These results show that peak tuned success alone does not establish broadly extractable goal-conditioned behavior. Trainability landscapes expose this gap, while extraction diagnostics offer a lower-cost lens on how learned signals become policies.

cs.LG↗

arXiv2026

Leveraging AutoML for Sustainable Deep Learning: A Multi-Objective HPO Approach on Deep Shift Neural Networks

Deep Learning (DL) has advanced various fields by extracting complex patterns from large datasets. However, the computational demands of DL models pose environmental and resource challenges. Deep Shift Neural Networks (DSNNs) present a solution by leveraging shift operations to reduce computational complexity at inference. Compared to common DNNs, DSNNs are still less well understood and less well optimized. By leveraging AutoML techniques, we provide valuable insights into the potential of DSNNs and how to design them in a better way. We focus on image classification, a core task in computer vision, especially in low-resource environments. Since we consider complementary objectives such as accuracy and energy consumption, we combine state-of-the-art multi-fidelity (MF) hyperparameter optimization (HPO) with multi-objective optimization to find a set of Pareto optimal trade-offs on how to design DSNNs. Our approach led to significantly better configurations of DSNNs regarding loss and emissions compared to default DSNNs. This includes simultaneously increasing performance by about 20% and reducing emissions, in some cases by more than 60%. Investigating the behavior of quantized networks in terms of both emissions and accuracy, our experiments reveal surprising model-specific trade-offs, yielding the greatest energy savings. For example, in contrast to common expectations, quantizing smaller portions of the network with low precision can be optimal with respect to energy consumption while retaining or improving performance. We corroborated these findings across multiple backbone architectures, highlighting important nuances in quantization strategies and offering an automated approach to balancing energy efficiency and model performance.

cs.LG↗

arXiv2026

Towards Leveraging AutoML for Sustainable Deep Learning: A Multi-Objective HPO Approach on Deep Shift Neural Networks

cs.LG↗

arXiv2026

Environment-Grounded Automated Prompt Optimization for LLM Game Agents

LLM agents in interactive environments are highly sensitive to their prompts, yet prompt engineering remains a manual, task-specific process. We introduce an automated prompt optimization framework for LLM agents that decomposes the observation-to-action pipeline into a goal-conditioned descriptor agent and an action selection agent, and iteratively refines each module's prompt through an LLM-driven evolutionary loop guided by environment returns. We propose a behavior analyzer to attribute episode outcomes to specific prompt components, and a mutator to propose targeted revisions to the prompt, before validating them through environment rollouts. We evaluate on all five BabyAI tasks in the BALROG benchmark, comparing our pipeline against BALROG's RobustCoTAgent under both plain and guided prompt initializations. Optimization improves performance consistently across tasks and conditions, without requiring updates to the model weights. On PutNext, a multi-step coordination task where the RobustCoTAgent achieves 0% success, our framework reaches up to 72.5% success rate using the same underlying LLM with optimized prompts. These results suggest that a multi-agent framework, combined with automatic prompt optimization, enhances LLMs without the need for fine-tuning or extensive human supervision.

cs.CL↗

arXiv2026

Provably Reduced Sample Cost in Prior-Guided Hyperparameter Optimization

Large-scale hyperparameter optimization (HPO) in automated machine learning (AutoML) consumes substantial computational resources, raising growing concerns about scalability and energy efficiency. Existing methods use prior information heuristically to accelerate both black-box and multi-fidelity settings, but they lack a characterization of how prior informativeness quantitatively reduces sample complexity. In this work, we provide the first distribution-dependent sample complexity bounds for multi-fidelity HPO with priors through the formal lens of fixed-budget best-arm identification. By modeling priors directly over arm means as configuration performance, we derive explicit, distribution-dependent error bounds that quantify the relationship between priors and evaluation budget. Our analysis shows that informative priors, which concentrate probability mass on near-optimal arms, yield reductions in the number of required evaluations, whereas baseline performance is recovered with uninformative or misleading priors. We conduct proof-of-concept experiments on a synthetic benchmark and on LCBench, a common multi-fidelity HPO benchmark for deep learning, to confirm our theoretical results, achieving up to 90% budget reduction while retaining solution quality. Together, our results provide a principled foundation for prior-guided and compute-efficient green AutoML.

cs.LG↗

arXiv2026

Neural Attention Search Linear: Towards Adaptive Token-Level Hybrid Attention Models

The quadratic computational complexity of softmax transformers has become a bottleneck in long-context scenarios. In contrast, linear attention model families provide a promising direction towards a more efficient sequential model. These linear attention models compress past KV values into a single hidden state, thereby efficiently reducing complexity during both training and inference. However, their expressivity remains limited by the size of their hidden state. Previous work proposed interleaving softmax and linear attention layers to reduce computational complexity while preserving expressivity. Nevertheless, the efficiency of these models remains bottlenecked by their softmax attention layers. In this paper, we propose Neural Attention Search Linear (NAtS-L), a framework that applies both linear attention and softmax attention operations within the same layer on different tokens. NAtS-L automatically determines whether a token can be handled by a linear attention model, i.e., tokens that have only short-term impact and can be encoded into fixed-size hidden states, or require softmax attention, i.e., tokens that contain information related to long-term retrieval and need to be preserved for future queries. By searching for optimal Gated DeltaNet and softmax attention combinations across tokens, we show that NAtS-L provides a strong yet efficient token-level hybrid architecture.

cs.CL↗

arXiv2026

Dynamic Hyperparameter Importance for Efficient Multi-Objective Optimization

Choosing a suitable ML model is a complex task that can depend on several objectives, e.g., accuracy, fairness, or energy consumption. In practice, this requires trading off multiple, often competing, objectives through multi-objective optimization (MOO). However, existing MOO methods typically treat all hyperparameters as equally important, disregarding that hyperparameter importance (HPI) can vary significantly across objectives. We propose a novel dynamic optimization approach that prioritizes the most influential hyperparameters based on varying objective trade-offs during the search, thereby accelerating empirical convergence. We advance prior work on HPI for MOO from post-analysis to direct, dynamic integration within the optimization, using the recent HPI method HyperSHAP. For this, we leverage the objective weightings naturally produced by the MOO algorithm ParEGO and reduce the configuration space by fixing the unimportant hyperparameters, allowing the search to focus on the important ones. Eventually, we evaluate our method on diverse tasks from PyMOO and YAHPO-Gym. For HPO, integrating HPI yields up to 24% improvement in final Pareto front quality, while on synthetic data, integrating HPI achieves 2x better final results.

cs.LG↗

arXiv2026

Gradient-Informed Bayesian and Interior Point Optimization for Efficient Inverse Design in Nanophotonics

Inverse design, particularly geometric shape optimization, provides a systematic approach for developing high-performance nanophotonic devices. While numerous optimization algorithms exist, previous global approaches exhibit slow convergence and conversely local search strategies frequently become trapped in local optima. To address the limitations inherent to both local and global approaches, we introduce BONNI: Bayesian optimization through neural network ensemble surrogates with interior point optimization. It augments global optimization with an efficient incorporation of gradient information to determine optimal sampling points. This capability allows BONNI to circumvent the local optima found in many nanophotonic applications, while capitalizing on the efficiency of gradient-based optimization. We demonstrate BONNI's capabilities in the design of a distributed Bragg reflector as well as a dual-layer grating coupler through an exhaustive comparison against other optimization algorithms commonly used in literature. Using BONNI, we were able to design a 10-layer distributed Bragg reflector with only 4.5% mean spectral error, compared to the previously reported results of 7.8% error with 16 layers. Further designs of a broadband waveguide taper and photonic crystal waveguide transition validate the capabilities of BONNI.

physics.optics↗

arXiv2026

ARLBench: Flexible and Efficient Benchmarking for Hyperparameter Optimization in Reinforcement Learning

Hyperparameters are a critical factor in reliably training well-performing reinforcement learning (RL) agents. Unfortunately, developing and evaluating automated approaches for tuning such hyperparameters is both costly and time-consuming. As a result, such approaches are often only evaluated on a single domain or algorithm, making comparisons difficult and limiting insights into their generalizability. We propose ARLBench, a benchmark for hyperparameter optimization (HPO) in RL that allows comparisons of diverse HPO approaches while being highly efficient in evaluation. To enable research into HPO in RL, even in settings with low compute resources, we select a representative subset of HPO tasks spanning a variety of algorithm and environment combinations. This selection allows for generating a performance profile of an automated RL (AutoRL) method using only a fraction of the compute previously necessary, enabling a broader range of researchers to work on HPO in RL. With the extensive and large-scale dataset on hyperparameter landscapes that our selection is based on, ARLBench is an efficient, flexible, and future-oriented foundation for research on AutoRL. Both the benchmark and the dataset are available at https://github.com/automl/arlbench.

cs.LG↗

arXiv2026

Evolutionary Mapping of Neural Networks to Spatial Accelerators

Spatial accelerators, composed of arrays of compute-memory integrated units, offer an attractive platform for deploying inference workloads with low latency and low energy consumption. However, fully exploiting their architectural advantages typically requires careful, expert-driven mapping of computational graphs to distributed processing elements. In this work, we automate this process by framing the mapping challenge as a black-box optimization problem. We introduce the first evolutionary, hardware-in-the-loop mapping framework for neuromorphic accelerators, enabling users without deep hardware knowledge to deploy workloads more efficiently. We evaluate our approach on Intel Loihi 2, a representative spatial accelerator featuring 152 cores per chip in a 2D mesh. Our method achieves up to 35% reduction in total latency compared to default heuristics on two sparse multi-layer perceptron networks. Furthermore, we demonstrate the scalability of our approach to multi-chip systems and observe an up to 40% improvement in energy efficiency, without explicitly optimizing for it.

cs.NE↗

arXiv2026

Practitioner Motives to Use Different Hyperparameter Optimization Methods

Programmatic hyperparameter optimization (HPO) methods, such as Bayesian optimization and evolutionary algorithms, are highly sample-efficient in identifying optimal hyperparameter configurations for machine learning (ML) models. However, practitioners frequently use less efficient methods, such as grid search, which can lead to under-optimized models. We suspect this behavior is driven by a range of practitioner-specific motives. Practitioner motives, however, still need to be clarified to enhance user-centered development of HPO tools. To uncover practitioner motives to use different HPO methods, we conducted 20 semi-structured interviews and an online survey with 49 ML experts. By presenting main goals (e.g., increase ML model understanding) and contextual factors affecting practitioners' selection of HPO methods (e.g., available computer resources), this study offers a conceptual foundation to better understand why practitioners use different HPO methods, supporting development of more user-centered and context-adaptive HPO tools in automated ML.

cs.LG↗

arXiv2026

Moments Matter:Stabilizing Policy Optimization using Return Distributions

Deep Reinforcement Learning (RL) agents often learn policies that achieve the same episodic return yet behave very differently, due to a combination of environmental (random transitions, initial conditions, reward noise) and algorithmic (minibatch selection, exploration noise) factors. In continuous control tasks, even small parameter shifts can produce unstable gaits, complicating both algorithm comparison and real-world transfer. Previous work has shown that such instability arises when policy updates traverse noisy neighborhoods and that the spread of post-update return distribution $R(θ)$, obtained by repeatedly sampling minibatches, updating $θ$, and measuring final returns, is a useful indicator of this noise. Although explicitly constraining the policy to maintain a narrow $R(θ)$ can improve stability, directly estimating $R(θ)$ is computationally expensive in high-dimensional settings. We propose an alternative that takes advantage of environmental stochasticity to mitigate update-induced variability. Specifically, we model state-action return distribution through a distributional critic and then bias the advantage function of PPO using higher-order moments (skewness and kurtosis) of this distribution. By penalizing extreme tail behaviors, our method discourages policies from entering parameter regimes prone to instability. We hypothesize that in environments where post-update critic values align poorly with post-update returns, standard PPO struggles to produce a narrow $R(θ)$. In such cases, our moment-based correction narrows $R(θ)$, improving stability by up to 75% in Walker2D, while preserving comparable evaluation returns.

cs.LG↗

arXiv2025

Best Practices For Empirical Meta-Algorithmic Research: Guidelines from the COSEAL Research Network

Empirical research on meta-algorithmics, such as algorithm selection, configuration, and scheduling, often relies on extensive and thus computationally expensive experiments. With the large degree of freedom we have over our experimental setup and design comes a plethora of possible error sources that threaten the scalability and validity of our scientific insights. Best practices for meta-algorithmic research exist, but they are scattered between different publications and fields, and continue to evolve separately from each other. In this report, we collect good practices for empirical meta-algorithmic research across the subfields of the COSEAL community, encompassing the entire experimental cycle: from formulating research questions and selecting an experimental design, to executing experiments, and ultimately, analyzing and presenting results impartially. It establishes the current state-of-the-art practices within meta-algorithmic research and serves as a guideline to both new researchers and practitioners in meta-algorithmic fields.

cs.AI↗

arXiv2025

DeepCAVE: A Visualization and Analysis Tool for Automated Machine Learning

Hyperparameter optimization (HPO), as a central paradigm of AutoML, is crucial for leveraging the full potential of machine learning (ML) models; yet its complexity poses challenges in understanding and debugging the optimization process. We present DeepCAVE, a tool for interactive visualization and analysis, providing insights into HPO. Through an interactive dashboard, researchers, data scientists, and ML engineers can explore various aspects of the HPO process and identify issues, untouched potentials, and new insights about the ML model being tuned. By empowering users with actionable insights, DeepCAVE contributes to the interpretability of HPO and ML on a design level and aims to foster the development of more robust and efficient methodologies in the future.

cs.LG↗

arXiv2025

HyperSHAP: Shapley Values and Interactions for Explaining Hyperparameter Optimization

Hyperparameter optimization (HPO) is a crucial step in achieving strong predictive performance. Yet, the impact of individual hyperparameters on model generalization is highly context-dependent, prohibiting a one-size-fits-all solution and requiring opaque HPO methods to find optimal configurations. However, the black-box nature of most HPO methods undermines user trust and discourages adoption. To address this, we propose a game-theoretic explainability framework for HPO based on Shapley values and interactions. Our approach provides an additive decomposition of a performance measure across hyperparameters, enabling local and global explanations of hyperparameters' contributions and their interactions. The framework, named HyperSHAP, offers insights into ablation studies, the tunability of learning algorithms, and optimizer behavior across different hyperparameter spaces. We demonstrate HyperSHAP's capabilities on various HPO benchmarks to analyze the interaction structure of the corresponding HPO problems, demonstrating its broad applicability and actionable insights for improving HPO.

cs.LG↗

arXiv2025

Optimizing Time Series Forecasting Architectures: A Hierarchical Neural Architecture Search Approach

The rapid development of time series forecasting research has brought many deep learning-based modules in this field. However, despite the increasing amount of new forecasting architectures, it is still unclear if we have leveraged the full potential of these existing modules within a properly designed architecture. In this work, we propose a novel hierarchical neural architecture search approach for time series forecasting tasks. With the design of a hierarchical search space, we incorporate many architecture types designed for forecasting tasks and allow for the efficient combination of different forecasting architecture modules. Results on long-term-time-series-forecasting tasks show that our approach can search for lightweight high-performing forecasting architectures across different forecasting tasks.

cs.LG↗