English
Related papers

Related papers: Evolutionary Retrosynthetic Route Planning

200 papers

Despite the success of metaheuristic algorithms in solving complex network optimization problems, they often struggle with adaptation, especially in dynamic or high-dimensional search spaces. Traditional approaches can become stuck in local…

Neural and Evolutionary Computing · Computer Science 2025-01-13 Boris Kriuk , Keti Sulamanidze , Fedor Kriuk

An integrated optimization method based on the constrained multi-objective evolutionary algorithm (MOEA) and non-intrusive polynomial chaos expansion (PCE) is proposed, which solves robust multi-objective optimization problems under…

Neural and Evolutionary Computing · Computer Science 2022-09-29 Yuji Takubo , Masahiro Kanazaki

Current computer-aided synthesis planning (CASP) methods often treat retrosynthesis as solved once a single feasible route is identified, focusing primarily on convergence or shortest-path metrics. This view is misaligned with real-world…

Artificial Intelligence · Computer Science 2026-05-27 Friedrich Hastedt , Dongda Zhang , Antonio del Rio Chanona

Evolutionary Algorithms (EAs) have been shown to be powerful tools for complex optimization problems, which are ubiquitous in both communication and big data analytics. This paper presents a new EA, namely Negatively Correlated Search…

Neural and Evolutionary Computing · Computer Science 2016-03-09 Ke Tang , Peng Yang , Xin Yao

Modern e-commerce search is evolving to resolve complex user intents. While Large Language Models (LLMs) offer strong reasoning, existing LLM-based paradigms face a fundamental blindness-latency dilemma: query rewriting is agnostic to…

Artificial Intelligence · Computer Science 2026-04-30 Mengxiang Chen , Zhouwei Zhai , Jin Li

Differential evolution (DE) is a well-known type of evolutionary algorithms (EA). Similarly to other EA variants it can suffer from small populations and loose diversity too quickly. This paper presents a new approach to mitigate this…

Neural and Evolutionary Computing · Computer Science 2020-02-10 Jakub M. Tomczak , Ewelina Weglarz-Tomczak , Agoston E. Eiben

Earth Observation Satellite Planning (EOSP) is a difficult optimization problem with considerable practical interest. A set of requested observations must be scheduled on an agile Earth observation satellite while respecting constraints on…

Artificial Intelligence · Computer Science 2025-11-27 Antoine Jacquet , Guillaume Infantes , Emmanuel Benazera , Vincent Baudoui , Jonathan Guerra , Stéphanie Roussel

Deep Reinforcement Learning (DRL) algorithms have been successfully applied to a range of challenging control tasks. However, these methods typically suffer from three core difficulties: temporal credit assignment with sparse rewards, lack…

Machine Learning · Computer Science 2018-10-30 Shauharda Khadka , Kagan Tumer

Evolutionary algorithms (EAs) are universal solvers inspired by principles of natural evolution. In many applications, EAs produce astonishingly good solutions. As they are able to deal with complex optimisation problems, they show great…

Neural and Evolutionary Computing · Computer Science 2024-09-25 Jakob Baumann , Ignaz Rutter , Dirk Sudholt

We introduce an automatic machine learning (AutoML) modeling architecture called Autostacker, which combines an innovative hierarchical stacking architecture and an Evolutionary Algorithm (EA) to perform efficient parameter search. Neither…

Machine Learning · Computer Science 2018-03-05 Boyuan Chen , Harvey Wu , Warren Mo , Ishanu Chattopadhyay , Hod Lipson

Evolutionary algorithms have been frequently used for dynamic optimization problems. With this paper, we contribute to the theoretical understanding of this research area. We present the first computational complexity analysis of…

Data Structures and Algorithms · Computer Science 2015-04-27 Frank Neumann , Carsten Witt

Restart strategy helps the covariance matrix adaptation evolution strategy (CMA-ES) to increase the probability of finding the global optimum in optimization, while a single run CMA-ES is easy to be trapped in local optima. In this paper,…

Neural and Evolutionary Computing · Computer Science 2020-04-28 Yang Lou , Shiu Yin Yuen , Guanrong Chen , Xin Zhang

The effectiveness of the machine learning methods for real-world tasks depends on the proper structure of the modeling pipeline. The proposed approach is aimed to automate the design of composite machine learning pipelines, which is…

Evolutionary algorithms (EAs), a large class of general purpose optimization algorithms inspired from the natural phenomena, are widely used in various industrial optimizations and often show excellent performance. This paper presents an…

Neural and Evolutionary Computing · Computer Science 2014-04-14 Yang Yu , Hong Qian

Multi-robot path planning is a computational process involving finding paths for each robot from its start to the goal while ensuring collision-free operation. It is widely used in robots and autonomous driving. However, the computational…

Robotics · Computer Science 2023-08-04 Biru Zhang , Jiankun Wang , Max Q. -H. Meng

Evolutionary Algorithms (EAs) have become the most popular tool for solving widely-existed multi-objective optimization problems. In Multi-Objective EAs (MOEAs), there is increasing interest in using an archive to store non-dominated…

Neural and Evolutionary Computing · Computer Science 2025-12-10 Shengjie Ren , Zimin Liang , Miqing Li , Chao Qian

Leveraging artificial intelligence for automatic retrosynthesis speeds up organic pathway planning in digital laboratories. However, existing deep learning approaches are unexplainable, like "black box" with few insights, notably limiting…

Machine Learning · Computer Science 2023-10-13 Yu Wang , Chao Pang , Yuzhe Wang , Yi Jiang , Junru Jin , Sirui Liang , Quan Zou , Leyi Wei

Machine learning models work better when curated features are provided to them. Feature engineering methods have been usually used as a preprocessing step to obtain or build a proper feature set. In late years, autoencoders (a specific type…

Neural and Evolutionary Computing · Computer Science 2023-01-18 Francisco Charte , Antonio J. Rivera , Francisco Martínez , María J. del Jesus

Now-a-days, it is important to find out solutions of Multi-Objective Optimization Problems (MOPs). Evolutionary Strategy helps to solve such real world problems efficiently and quickly. But sequential Evolutionary Algorithms (EAs) require…

Neural and Evolutionary Computing · Computer Science 2016-11-15 Md. Asadul Islam , G. M. Mashrur-E-Elahi , M. M. A. Hashem

Efficient and automated design of optimizers plays a crucial role in full-stack AutoML systems. However, prior methods in optimizer search are often limited by their scalability, generability, or sample efficiency. With the goal of…

Machine Learning · Computer Science 2022-09-29 Ruochen Wang , Yuanhao Xiong , Minhao Cheng , Cho-Jui Hsieh
‹ Prev 1 3 4 5 6 7 10 Next ›