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This paper presents a method called sampling-computation-optimization (SCO) to design batch Bayesian optimization. SCO does not construct new high-dimensional acquisition functions but samples from the existing one-site acquisition function…

Optimization and Control · Mathematics 2022-02-22 Kai Jia , Xiaojun Duan , Zhengming Wang , Liang Yan

In this paper we present a sampling framework for RNA structures of fixed topological genus. We introduce a novel, linear time, uniform sampling algorithm for RNA structures of fixed topological genus $g$, for arbitrary $g>0$. Furthermore…

Computational Engineering, Finance, and Science · Computer Science 2013-04-30 Fenix W. D. Huang , Markus E. Nebel , Christian M. Reidys

Machine-learning models that learn from data to predict how protein sequence encodes function are emerging as a useful protein engineering tool. However, when using these models to suggest new protein designs, one must deal with the vast…

Quantitative Methods · Quantitative Biology 2021-07-07 Brian L. Hie , Kevin K. Yang

Any optimization algorithm programming interface can be seen as a black-box function with additional free parameters. In this spirit, simulated annealing (SA) can be implemented in pseudo-code within the dimensions of a single slide with…

Software Engineering · Computer Science 2023-02-27 Rohit Goswami , Ruhila S. , Amrita Goswami , Sonaly Goswami , Debabrata Goswami

Quality by design in pharmaceutical manufacturing hinges on computational methods and tools that are capable of accurate quantitative prediction of the design space. This paper investigates Bayesian approaches to design space…

Preference optimization offers a scalable supervision paradigm based on relative preference signals, yet prior attempts in medical image segmentation remain model-specific and rely on low-diversity prediction sampling. In this paper, we…

Computer Vision and Pattern Recognition · Computer Science 2025-12-18 Yunseong Nam , Jiwon Jang , Dongkyu Won , Sang Hyun Park , Soopil Kim

Artificial RNA molecules with novel functionality have many applications in synthetic biology, pharmacy and white biotechnology. The de novo design of such devices using computational methods and prediction tools is a resource-efficient…

Biomolecules · Quantitative Biology 2019-05-13 Stefan Hammer , Christian Günzel , Mario Mörl , Sven Findeiß

Cardiac magnetic resonance imaging (CMR) is vital for diagnosing heart diseases, but long scan time remains a major drawback. To address this, accelerated imaging techniques have been introduced by undersampling k-space, which reduces the…

Computer Vision and Pattern Recognition · Computer Science 2025-02-24 Donghang Lyu , Chinmay Rao , Marius Staring , Matthias J. P. van Osch , Mariya Doneva , Hildo J. Lamb , Nicola Pezzotti

Aircraft aerodynamic design optimization must account for the varying operating conditions along the cruise segment as opposed to designing at one fixed operating condition, to arrive at more realistic designs. Conventional approaches…

Optimization and Control · Mathematics 2025-12-03 Kade Carlson , Ashwin Renganathan

Recent works have proposed optimal subsampling algorithms to improve computational efficiency in large datasets and to design validation studies in the presence of measurement error. Existing approaches generally fall into two categories:…

Methodology · Statistics 2025-12-25 Jasper B. Yang , Thomas Lumley , Bryan E. Shepherd , Pamela A. Shaw

Despite the performance advantages of modern sampling-based motion planners, solving high dimensional planning problems in near real-time remains a challenge. Applications include hyper-redundant manipulators, snake-like and humanoid…

Robotics · Computer Science 2018-02-02 Marios P. Xanthidis , Joel M. Esposito , Ioannis Rekleitis , Jason M. O'Kane

Antibody design, a crucial task with significant implications across various disciplines such as therapeutics and biology, presents considerable challenges due to its intricate nature. In this paper, we tackle antigen-specific antibody…

Biomolecules · Quantitative Biology 2024-10-29 Xiangxin Zhou , Dongyu Xue , Ruizhe Chen , Zaixiang Zheng , Liang Wang , Quanquan Gu

Markov Chain Monte Carlo (MCMC) methods sample from unnormalized probability distributions and offer guarantees of exact sampling. However, in the continuous case, unfavorable geometry of the target distribution can greatly limit the…

Machine Learning · Statistics 2020-10-09 Zengyi Li , Yubei Chen , Friedrich T. Sommer

Sample patterns have many uses in Computer Graphics, ranging from procedural object placement over Monte Carlo image synthesis to non-photorealistic depiction. Their properties such as discrepancy, spectra, anisotropy, or progressiveness…

Graphics · Computer Science 2018-06-19 Thomas Leimkühler , Gurprit Singh , Karol Myszkowski , Hans-Peter Seidel , Tobias Ritschel

The goal of survey design is often to minimize the errors associated with inference: the total of bias and variance. Random surveys are common because they allow the use of theoretically unbiased estimators. In practice however, such…

Methodology · Statistics 2023-02-14 Connie Okasaki , Sándor F. Tóth , Andrew M. Berdahl

A surrogate-based synthesis framework for antenna arrays is presented that incorporates mutual coupling while keeping optimization computationally efficient. The method combines a common characteristic-mode basis, a global modal coupling…

Signal Processing · Electrical Eng. & Systems 2026-05-25 Leonardo Mörlein , Dirk Manteuffel

To accelerate MRI, the field of compressed sensing is traditionally concerned with optimizing the image quality after a partial undersampling of the measurable $\textit{k}$-space. In our work, we propose to change the focus from the quality…

Image and Video Processing · Electrical Eng. & Systems 2022-11-15 Artem Razumov , Oleg Y. Rogov , Dmitry V. Dylov

With appropriately chosen sampling probabilities, sampling-based random projection can be used to implement large-scale statistical methods, substantially reducing computational cost while maintaining low statistical error. However,…

Machine Learning · Statistics 2026-01-13 Yifan Chen , Yun Yang

We investigate the weighted sum-rate (WSR) maximization linear precoder design for massive multiple-input multiple-output (MIMO) downlink. We consider a single-cell system with multiple users and propose a unified matrix manifold…

Information Theory · Computer Science 2024-04-12 Rui Sun , Chen Wang , An-An Lu , Xiqi Gao , Xiang-Gen Xia

Asymptotically-optimal motion planners such as RRT* have been shown to incrementally approximate the shortest path between start and goal states. Once an initial solution is found, their performance can be dramatically improved by…

Robotics · Computer Science 2017-10-18 Daqing Yi , Rohan Thakker , Cole Gulino , Oren Salzman , Siddhartha Srinivasa
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