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Optimization and control of complex unsteady flows remains an important challenge due to the large cost of performing a function evaluation, i.e. a full computational fluid dynamics (CFD) simulation. Reducing the number of required function…

Fluid Dynamics · Physics 2023-01-31 A. Quirós Rodríguez , M. Fosas de Pando , T. Sayadi

We propose RSO (random search optimization), a gradient free Markov Chain Monte Carlo search based approach for training deep neural networks. To this end, RSO adds a perturbation to a weight in a deep neural network and tests if it reduces…

Machine Learning · Computer Science 2020-05-13 Rohun Tripathi , Bharat Singh

In this paper, we study the problem of constrained robust (min-max) optimization ina black-box setting, where the desired optimizer cannot access the gradients of the objective function but may query its values. We present a principled…

Machine Learning · Computer Science 2020-06-18 Sijia Liu , Songtao Lu , Xiangyi Chen , Yao Feng , Kaidi Xu , Abdullah Al-Dujaili , Minyi Hong , Una-May O'Reilly

Molecule optimization is an important problem in chemical discovery and has been approached using many techniques, including generative modeling, reinforcement learning, genetic algorithms, and much more. Recent work has also applied…

Biomolecules · Quantitative Biology 2022-10-31 Elvin Lo , Pin-Yu Chen

In physics and engineering, many processes are modeled using non-differentiable black-box simulators, making the optimization of such functions particularly challenging. To address such cases, inspired by the Gradient Theorem, we propose…

Global optimization of black-box functions is challenging in high dimensions. We introduce a conceptual adaptive random search framework, Branching Adaptive Surrogate Search Optimization (BASSO), that combines partitioning and surrogate…

Optimization and Control · Mathematics 2025-04-28 Pariyakorn Maneekul , Zelda B. Zabinsky , Giulia Pedrielli

Fine-tuning large language models (LLMs) using zeroth-order (ZO) optimization has emerged as a promising alternative to traditional gradient-based methods due to its reduced memory footprint requirement. However, existing ZO methods suffer…

Machine Learning · Computer Science 2025-10-22 Zhendong Mi , Qitao Tan , Grace Li Zhang , Zhaozhuo Xu , Geng Yuan , Shaoyi Huang

Global optimization of expensive, derivative-free black-box functions requires extreme sample efficiency. While Bayesian optimization (BO) is the current state-of-the-art, its performance hinges on surrogate and acquisition function…

Machine unlearning seeks to remove the influence of designated training data while preserving performance on the remaining data. Approximate unlearning can be viewed as a local editing problem; in min-max unlearning, the key local object is…

Machine Learning · Computer Science 2026-05-08 Junhao Cai , Dohun Kim , Dowon Kim , Sung Il Choi , Chengjun Jin , Juhyun Park , Changhee Joo

Binary optimization, a representative subclass of discrete optimization, plays an important role in mathematical optimization and has various applications in computer vision and machine learning. Usually, binary optimization problems are…

Optimization and Control · Mathematics 2021-05-18 Huan Xiong , Mengyang Yu , Li Liu , Fan Zhu , Fumin Shen , Ling Shao

We study an extension of contextual stochastic linear optimization (CSLO) that, in contrast to most of the existing literature, involves inequality constraints that depend on uncertain parameters predicted by a machine learning model. To…

Machine Learning · Computer Science 2025-05-30 Hyungki Im , Wyame Benslimane , Paul Grigas

Fine-tuning language models (LMs) with the Adam optimizer often demands excessive memory, limiting accessibility. The "in-place" version of Stochastic Gradient Descent (IP-SGD) and Memory-Efficient Zeroth-order Optimizer (MeZO) have been…

Machine Learning · Computer Science 2024-10-10 Zeman Li , Xinwei Zhang , Peilin Zhong , Yuan Deng , Meisam Razaviyayn , Vahab Mirrokni

Prediction+optimization is a common real-world paradigm where we have to predict problem parameters before solving the optimization problem. However, the criteria by which the prediction model is trained are often inconsistent with the goal…

Machine Learning · Computer Science 2021-11-23 Kai Yan , Jie Yan , Chuan Luo , Liting Chen , Qingwei Lin , Dongmei Zhang

Decentralized sparsity learning has attracted a significant amount of attention recently due to its rapidly growing applications. To obtain the robust and sparse estimators, a natural idea is to adopt the non-smooth median loss combined…

Machine Learning · Statistics 2022-03-02 Weidong Liu , Xiaojun Mao , Xin Zhang

To solve unmodeled optimization problems with hard constraints, this paper proposes a novel zeroth-order approach called Safe Zeroth-order Optimization using Linear Programs (SZO-LP). The SZO-LP method solves a linear program in each…

Optimization and Control · Mathematics 2023-04-05 Baiwei Guo , Yang Wang , Yuning Jiang , Maryam Kamgarpour , Giancarlo Ferrari-Trecate

The exploration of novel architectures requires physics-based simulation due to a lack of prior experience to start from, which introduces two specific challenges for optimization algorithms: evaluations become more expensive (in time) and…

Machine Learning · Computer Science 2025-04-14 Jasper Bussemaker , Paul Saves , Nathalie Bartoli , Thierry Lefebvre , Björn Nagel

We develop universal gradient methods for Stochastic Convex Optimization (SCO). Our algorithms automatically adapt not only to the oracle's noise but also to the H\"older smoothness of the objective function without a priori knowledge of…

Optimization and Control · Mathematics 2024-07-12 Anton Rodomanov , Ali Kavis , Yongtao Wu , Kimon Antonakopoulos , Volkan Cevher

Stochastic compositional optimization (SCO) has attracted considerable attention because of its broad applicability to important real-world problems. However, existing works on SCO assume that the projection within a solution update is…

Optimization and Control · Mathematics 2025-05-27 Shuoguang Yang , Wei You , Zhe Zhang , Ethan X. Fang

Fine-tuning large language models (LLMs) often faces GPU memory bottlenecks: the backward pass of first-order optimizers like Adam increases memory usage to more than 10 times the inference level (e.g., 633 GB for OPT-30B). Zeroth-order…

Machine Learning · Computer Science 2025-07-01 Sizhe Dang , Yangyang Guo , Yanjun Zhao , Haishan Ye , Xiaodong Zheng , Guang Dai , Ivor Tsang

In this paper we combine two important extensions of ordinary least squares regression: regularization and optimal scaling. Optimal scaling (sometimes also called optimal scoring) has originally been developed for categorical data, and the…

Machine Learning · Statistics 2016-11-17 Jacqueline J. Meulman , Anita J. van der Kooij