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Molecular retrosynthesis is a significant and complex problem in the field of chemistry, however, traditional manual synthesis methods not only need well-trained experts but also are time-consuming. With the development of big data and…

Artificial Intelligence · Computer Science 2024-07-16 Yan Zhang , Hao Hao , Xiao He , Shuanhu Gao , Aimin Zhou

Initialization profoundly affects evolutionary algorithm (EA) efficacy by dictating search trajectories and convergence. This study introduces a hybrid initialization strategy combining empty-space search algorithm (ESA) and…

Neural and Evolutionary Computing · Computer Science 2025-05-12 Xinyu Zhang , Mário Antunes , Tyler Estro , Erez Zadok , Klaus Mueller

Accurate short-term wind speed forecasting is essential for large-scale integration of wind power generation. However, the seasonal and stochastic characteristics of wind speed make forecasting a challenging task. This study uses a new…

Neural and Evolutionary Computing · Computer Science 2020-02-24 Mehdi Neshat , Meysam Majidi Nezhad , Ehsan Abbasnejad , Lina Bertling Tjernberg , Davide Astiaso Garcia , Bradley Alexander , Markus Wagner

Parameter-Efficient Fine-Tuning (PEFT), particularly Low-Rank Adaptation (LoRA), has become a standard approach for adapting Large Language Models (LLMs) under limited compute. However, in continual settings where models are updated…

Machine Learning · Computer Science 2026-05-14 Hung Le , Svetha Venkatesh

This paper presents an evolutionary algorithm with a new goal-sequence domination scheme for better decision support in multi-objective optimization. The approach allows the inclusion of advanced hard/soft priority and constraint…

Artificial Intelligence · Computer Science 2011-06-02 E. F. Khor , T. H. Lee , R. Sathikannan , K. C. Tan

In building practical applications of evolutionary computation (EC), two optimizations are essential. First, the parameters of the search method need to be tuned to the domain in order to balance exploration and exploitation effectively.…

Neural and Evolutionary Computing · Computer Science 2023-04-25 Hormoz Shahrzad , Risto Miikkulainen

Fine-tuning large-scale pre-trained models is prohibitively expensive in terms of computation and memory costs. Low-Rank Adaptation (LoRA), a popular Parameter-Efficient Fine-Tuning (PEFT) method, offers an efficient solution by optimizing…

Machine Learning · Computer Science 2025-05-27 Tao Li , Zhengbao He , Yujun Li , Yasheng Wang , Lifeng Shang , Xiaolin Huang

In this paper we present an evolutionary optimization approach to solve the risk parity portfolio selection problem. While there exist convex optimization approaches to solve this problem when long-only portfolios are considered, the…

Portfolio Management · Quantitative Finance 2015-04-14 Ronald Hochreiter

A new likelihood based AR approximation is given for ARMA models. The usual algorithms for the computation of the likelihood of an ARMA model require $O(n)$ flops per function evaluation. Using our new approximation, an algorithm is…

Statistics Theory · Mathematics 2016-11-04 A. Ian McLeod , Ying Zhang

Large Language Models (LLMs) have transformed both everyday life and scientific research. However, adapting LLMs from general-purpose models to specialized tasks remains challenging, particularly in resource-constrained environments.…

Machine Learning · Computer Science 2025-09-12 Hao Zhang , Bo Huang , Zhenjia Li , Xi Xiao , Hui Yi Leong , Zumeng Zhang , Xinwei Long , Tianyang Wang , Hao Xu

The analysis of vast amounts of data constitutes a major challenge in modern high energy physics experiments. Machine learning (ML) methods, typically trained on simulated data, are often employed to facilitate this task. Several choices…

High Energy Physics - Experiment · Physics 2021-02-25 Laurits Tani , Diana Rand , Christian Veelken , Mario Kadastik

In this work, we leverage ensemble learning as a tool for the creation of faster, smaller, and more accurate deep learning models. We demonstrate that we can jointly optimize for accuracy, inference time, and the number of parameters by…

Neural and Evolutionary Computing · Computer Science 2021-05-04 Marc Ortiz , Florian Scheidegger , Marc Casas , Cristiano Malossi , Eduard Ayguadé

Analyzing the relation between a set of biological sequences can help to identify and understand the evolutionary history of these sequences and the functional relations among them. Multiple Sequence Alignment (MSA) is the main obstacle to…

Quantitative Methods · Quantitative Biology 2017-08-07 Sara Shehab , Sameh Shohdy , Arabi E. Keshk

We design a new distribution over $\poly(r \eps^{-1}) \times n$ matrices $S$ so that for any fixed $n \times d$ matrix $A$ of rank $r$, with probability at least 9/10, $\norm{SAx}_2 = (1 \pm \eps)\norm{Ax}_2$ simultaneously for all $x \in…

Data Structures and Algorithms · Computer Science 2013-04-08 Kenneth L. Clarkson , David P. Woodruff

Dictionary learning for sparse representations has been successful in many reconstruction tasks. Simplicial learning is an adaptation of dictionary learning, where subspaces become clipped and acquire arbitrary offsets, taking the form of…

Machine Learning · Computer Science 2020-05-19 Yigit Oktar , Mehmet Turkan

Evolutionary computing, particularly genetic algorithm (GA), is a combinatorial optimization method inspired by natural selection and the transmission of genetic information, which is widely used to identify optimal solutions to complex…

Neural and Evolutionary Computing · Computer Science 2024-12-31 Shanqing Yu , Meng Zhou , Jintao Zhou , Minghao Zhao , Yidan Song , Yao Lu , Zeyu Wang , Qi Xuan

Branch-specific substitution models are popular for detecting evolutionary change-points, such as shifts in selective pressure. However, applying such models typically requires prior knowledge of change-point locations on the phylogeny or…

Populations and Evolution · Quantitative Biology 2026-05-06 Xiang Ji , Benjamin Redelings , Shuo Su , Hongcun Bao , Wu-Min Deng , Samuel L. Hong , Guy Baele , Philippe Lemey , Marc A. Suchard

The Multiple Sequence Alignment (MSA) is a computational abstraction that represents a partial summary either of indel history, or of structural similarity. Taking the former view (indel history), it is possible to use formal automata…

Populations and Evolution · Quantitative Biology 2015-06-04 Oscar Westesson , Gerton Lunter , Benedict Paten , Ian Holmes

This paper considers the two-stage capacitated facility location problem (TSCFLP) in which products manufactured in plants are delivered to customers via storage depots. Customer demands are satisfied subject to limited plant production and…

Optimization and Control · Mathematics 2016-05-24 Peng Guo , Wenming Cheng , Yi Wang

Efficient transfer learning (ETL) is receiving increasing attention to adapt large pre-trained language-vision models on downstream tasks with a few labeled samples. While significant progress has been made, we reveal that state-of-the-art…

Computer Vision and Pattern Recognition · Computer Science 2024-03-27 Julio Silva-Rodríguez , Sina Hajimiri , Ismail Ben Ayed , Jose Dolz