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 Optimization


ADifference-of-Convex Functions Approach to Energy-Based Iterative Reasoning

Neural Information Processing Systems

While energy-based models have recently proven to be a powerful framework for learning to reason with neural networks, their practical application is still limited by computational cost. That is, existing methods for energy-based iterative reasoning suffer from computational bottlenecks by relying on expensive optimization routines during training and especially during inference.


Fast Rank-1 Lattice Targeted Sampling for Black-box Optimization Anonymous Author(s) Affiliation Address email

Neural Information Processing Systems

Black-box optimization has gained great attention for its success in recent ap-1 plications. However, scaling up to high-dimensional problems with good query2 efficiency remains challenging. This paper proposes a novel Rank-1 Lattice Tar-3 geted Sampling (RLTS) technique to address this issue. Our RLTS benefits from4 random rank-1 lattice Quasi-Monte Carlo, which enables us to perform fast local5 exact Gaussian processes (GP) training and inference with O(nlogn)complexity6 w.r.t.


Training-Free Constrained Generation With Stable Diffusion Models

Neural Information Processing Systems

Stable diffusion models represent the state-of-the-art in data synthesis across diverse domains and hold transformative potential for applications in science and engineering, e.g., by facilitating the discovery of novel solutions and simulating systems that are computationally intractable to model explicitly. While there is increasing effort to incorporate physics-based constraints into generative models, existing techniques are either limited in their applicability to latent diffusion frameworks or lack the capability to strictly enforce domain-specific constraints. To address this limitation this paper proposes a novel integration of stable diffusion models with constrained optimization frameworks, enabling the generation of outputs satisfying stringent physical and functional requirements.


Differentially Private Bilevel Optimization: Efficient Algorithms with Near-Optimal Rates

Neural Information Processing Systems

Bilevel optimization, in which one optimization problem is nested inside another, underlies many machine learning applications with a hierarchical structure--such as meta-learning and hyperparameter optimization. Such applications often involve sensitive training data, raising pressing concerns about individual privacy. Motivated by this, we study differentially private bilevel optimization. We first focus on settings where the outer-level objective is convex, and provide novel upper and lower bounds on the excess empirical risk for both pure and approximate differential privacy. These bounds are nearly tight and essentially match the optimal rates for standard single-level differentially private ERM, up to additional terms that capture the intrinsic complexity of the nested bilevel structure.


AutoOpt: ADataset and a Unified Framework for Automating Optimization Problem Solving

Neural Information Processing Systems

This study presents AutoOpt-11k, a unique image dataset of over 11,000 handwritten and printed mathematical optimization models corresponding to single-objective, multi-objective, multi-level, and stochastic optimization problems exhibiting various types of complexities such as non-linearity, nonconvexity, non-differentiability, discontinuity, and high-dimensionality. The labels consist of the LaTeX representation for all the images and modeling language representation for a subset of images. The dataset is created by 25 experts following ethical data creation guidelines and verified in two-phases to avoid errors. Further, we develop AutoOpt framework, a machine learning based automated approach for solving optimization problems, where the user just needs to provide an image of the formulation and AutoOpt solves it efficiently without any further human intervention. AutoOpt framework consists of three Modules: (i) M1 (Image_to_Text)- a deep learning model performs the Mathematical Expression Recognition (MER) task to generate the LaTeX code corresponding to the optimization formulation in image; (ii) M2 (Text_to_Text)- a small-scale fine-tuned LLM generates the PYOMO script (optimization modeling language) from LaTeX code; (iii) M3 (Optimization)- a Bilevel Optimization based Decomposition (BOBD) method solves the optimization formulation described in the PYOMO script. We use AutoOpt-11k dataset for training and testing of deep learning models employed in AutoOpt. The deep learning model for MER task (M1) outperforms ChatGPT, Gemini and Nougat on BLEU score metric. BOBD method (M3), which is a hybrid approach, yields better results on complex test problems compared to common approaches, like interior-point algorithm and genetic algorithm.


AComputationally Viable Numerical Gradient-based Technique for Optimal Covering Problems

Neural Information Processing Systems

The problem of optimally covering a given compact subset of RN with a preassigned number n of Euclidean metric balls has a long-standing history and it is well-recognized to be computationally hard. This article establishes a numerically viable algorithm for obtaining optimal covers of compact sets via two key contributions. The first is a foundational result establishing Lipschitz continuity of the marginal function of a certain parametric non-convex maximization problem in the optimal covering problem, and it provides the substrate for numerical gradient algorithms to be employed in this context. The second is an adaptation of a stochastically smoothed numerical gradient-based (zeroth-order) algorithm for a non-convex minimization problem, that, equipped with randomized restarts, spurs global convergence to an optimal cover. Several numerical experiments with complicated nonconvex compact sets demonstrate the excellent performance of our techniques.


Seeing through Uncertainty: Robust Task-Oriented Optimization in Visual Navigation

Neural Information Processing Systems

Visual navigation is a fundamental problem in embodied AI, yet practical deployments demand long-horizon planning capabilities to address multi-objective tasks. A major bottleneck is data scarcity: policies learned from limited data often overfit and fail to generalize OOD. Existing neural network-based agents typically increase architectural complexity that paradoxically become counterproductive in the smallsample regime. This paper introduce NEURO, a integrated learning-to-optimize framework that tightly couples perception networks with downstream task-level robust optimization. Specifically, NEURO addresses core difficulties in this integration: (i) it transforms noisy visual predictions under data scarcity into convex uncertainty sets using Partially Input Convex Neural Networks (PICNNs) with conformal calibration, which directly parameterize the optimization constraints; and (ii) it reformulates planning under partial observability as a robust optimization problem, enabling uncertainty-aware policies that transfer across environments. Extensive experiments on both unordered and sequential multi-object navigation tasks demonstrate that NEURO establishes SoTA performance, particularly in generalization to unseen environments. Our work thus presents a significant advancement for developing robust, generalizable autonomous agents.


Looking Beyond the Known: Towards a Data Discovery Guided Open-World Object Detection

Neural Information Processing Systems

Open-World Object Detection (OWOD) enriches traditional object detectors by enabling continual discovery and integration of unknown objects via human guidance. However, existing OWOD approaches frequently suffer from semantic confusion between known and unknown classes, alongside catastrophic forgetting, leading to diminished unknown recall and degraded known-class accuracy. To overcome these challenges, we propose Combinatorial Open-World Detection (CROWD2), a unified framework reformulating unknown object discovery and adaptation as an interwoven combinatorial (set-based) data-discovery (CROWD-Discover) and representation learning (CROWD-Learn) task. CROWD-Discover strategically mines unknown instances by maximizing Submodular Conditional Gain (SCG) functions, selecting representative examples distinctly dissimilar from known objects. Subsequently, CROWD-Learn employs novel combinatorial objectives that jointly disentangle known and unknown representations while maintaining discriminative coherence among known classes, thus mitigating confusion and forgetting. Extensive evaluations on OWOD benchmarks illustrate that CROWD achieves improvements of 2.83% and 2.05% in known-class accuracy on M-OWODB and S-OWODB, respectively, and nearly 2.4 unknown recall compared to leading baselines. Figure 1: Overall Architecture of CROWD showing our novel combinatorial data-discovery guided representation learning approach to (a) identify unknown objects3 and (b) learn distinguishable representations of both known and unknown objects.


Towards Generalizable Multi-Policy Optimization with Self-Evolution for Job Scheduling

Neural Information Processing Systems

Reinforcement Learning (RL) has shown promising results in solving Job Scheduling Problems (JSPs), automatically deriving powerful dispatching rules from data without relying on expert knowledge. However, most RL-based methods train only a single decision-maker, which limits exploration capability and leaves significant room for performance improvement. Moreover, designing reward functions for different JSP variants remains a challenging and labor-intensive task. To address these limitations, we introduce a novel and generic learning framework that optimizes multiple policies sharing a common objective and a single neural network, while enabling each policy to learn specialized and diverse strategies. The model optimization process is fully guided by a self-labeling manner, eliminating the need for reward functions. In addition, we develop a training scheme that adaptively controls the imitation intensity to reflect the quality of self-labels. Experimental results show that our method effectively addresses the aforementioned challenges and significantly outperforms state-of-the-art RL methods across six JSP variants. Furthermore, our approach also demonstrates strong performance on other combinatorial optimization problems, highlighting its versatility beyond JSPs.


Efficient Quadratic Corrections for Frank-Wolfe Algorithms

Neural Information Processing Systems

We develop a Frank-Wolfe algorithm with corrective steps, generalizing previous algorithms including Blended Conditional Gradients, Blended Pairwise Conditional Gradients, and Fully-Corrective Frank-Wolfe. For this, we prove tight convergence guarantees together with an optimal face identification property. Furthermore, we propose two highly efficient corrective steps for convex quadratic objectives based on linear optimization or linear system solving, akin to Wolfe's MinimumNorm Point algorithm, and prove finite-time convergence under suitable conditions. Beyond optimization problems that are directly quadratic, we revisit two algorithms, Split Conditional Gradient and Second-Order Conditional Gradient Sliding, which can leverage quadratic corrections to accelerate the solution of their quadratic subproblems. We show improved convergence rates for the first and prove broader applicability for the second. Finally, we demonstrate substantial computational speedups for Frank-Wolfe-based algorithms with quadratic corrections across the considered problem classes.