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Related papers: Massively Multitask Networks for Drug Discovery

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Time series models such as dynamical systems are frequently fitted to a cohort of data, ignoring variation between individual entities such as patients. In this paper we show how these models can be personalised to an individual level while…

Machine Learning · Computer Science 2019-03-22 Alex Bird , Christopher K. I. Williams , Christopher Hawthorne

In human learning, it is common to use multiple sources of information jointly. However, most existing feature learning approaches learn from only a single task. In this paper, we propose a novel multi-task deep network to learn…

Computer Vision and Pattern Recognition · Computer Science 2017-11-27 Zhongzheng Ren , Yong Jae Lee

Transfer learning can boost the performance on the targettask by leveraging the knowledge of the source domain. Recent worksin neural architecture search (NAS), especially one-shot NAS, can aidtransfer learning by establishing sufficient…

Computer Vision and Pattern Recognition · Computer Science 2021-05-20 Ming Sun , Haoxuan Dou , Junjie Yan

Predicting the structure of multi-protein complexes is a grand challenge in biochemistry, with major implications for basic science and drug discovery. Computational structure prediction methods generally leverage pre-defined structural…

Biomolecules · Quantitative Biology 2021-01-26 Stephan Eismann , Raphael J. L. Townshend , Nathaniel Thomas , Milind Jagota , Bowen Jing , Ron O. Dror

Understanding the structural complexity and predictability of complex networks is a central challenge in network science. Although recent studies have revealed a relationship between compression-based entropy and link prediction…

Social and Information Networks · Computer Science 2025-10-14 Sebastián Brzovic , Cristóbal Rojas , Andrés Abeliuk

Multi-agent reinforcement learning shines as the pinnacle of multi-agent systems, conquering intricate real-world challenges, fostering collaboration and coordination among agents, and unleashing the potential for intelligent…

Multiagent Systems · Computer Science 2023-12-27 Jiawei Wang , Jian Zhao , Zhengtao Cao , Ruili Feng , Rongjun Qin , Yang Yu

With the development of computer-assisted techniques, research communities including biochemistry and deep learning have been devoted into the drug discovery field for over a decade. Various applications of deep learning have drawn great…

Machine Learning · Computer Science 2023-03-07 Wenhao Hu , Yingying Liu , Xuanyu Chen , Wenhao Chai , Hangyue Chen , Hongwei Wang , Gaoang Wang

Multi-task learning shows strikingly inconsistent results -- sometimes joint training helps substantially, sometimes it actively harms performance -- yet the field lacks a principled framework for predicting these outcomes. We identify a…

Machine Learning · Computer Science 2026-04-10 Jasper Zhang , Bryan Cheng

The growing capacity of neural networks has strongly contributed to their success at complex machine learning tasks and the computational demand of such large models has, in turn, stimulated a significant improvement in the hardware…

Machine Learning · Computer Science 2021-04-27 Mohammed Amer , Tomás Maul , Iman Yi Liao

In important applications involving multi-task networks with multiple objectives, agents in the network need to decide between these multiple objectives and reach an agreement about which single objective to follow for the network. In this…

Optimization and Control · Mathematics 2018-12-27 Sahar Khawatmi , Abdelhak M. Zoubir , Ali H. Sayed

Measuring Efficiency in neural network system development is an open research problem. This paper presents an experimental framework to measure the training efficiency of a neural architecture. To demonstrate our approach, we analyze the…

Machine Learning · Computer Science 2024-09-13 Eduardo Cueto-Mendoza , John D. Kelleher

Autonomous materials research systems allow scientists to fail smarter, learn faster, and spend less resources in their studies. As these systems grow in number, capability, and complexity, a new challenge arises - how will they work…

Multiagent Systems · Computer Science 2023-03-21 A. Gilad Kusne , Austin McDannald

Imitation learning from large multi-task demonstration datasets has emerged as a promising path for building generally-capable robots. As a result, 1000s of hours have been spent on building such large-scale datasets around the globe.…

Time series datasets are often composed of a variety of sequences from the same domain, but from different entities, such as individuals, products, or organizations. We are interested in how time series models can be specialized to…

Machine Learning · Computer Science 2022-10-11 Alex Bird , Christopher K. I. Williams , Christopher Hawthorne

Multitask learning is a framework that enforces multiple learning tasks to share knowledge to improve their generalization abilities. While shallow multitask learning can learn task relations, it can only handle predefined features. Modern…

Machine Learning · Computer Science 2022-07-05 Guangji Bai , Liang Zhao

We show that deep neural networks trained across diverse tasks exhibit remarkably similar low-dimensional parametric subspaces. We provide the first large-scale empirical evidence that demonstrates that neural networks systematically…

Machine Learning · Computer Science 2025-12-09 Prakhar Kaushik , Shravan Chaudhari , Ankit Vaidya , Rama Chellappa , Alan Yuille

Multi-task reinforcement learning endeavors to accomplish a set of different tasks with a single policy. To enhance data efficiency by sharing parameters across multiple tasks, a common practice segments the network into distinct modules…

Artificial Intelligence · Computer Science 2024-01-26 Jinmin He , Kai Li , Yifan Zang , Haobo Fu , Qiang Fu , Junliang Xing , Jian Cheng

The key to success in machine learning (ML) is the use of effective data representations. Traditionally, data representations were hand-crafted. Recently it has been demonstrated that, given sufficient data, deep neural networks can learn…

Machine Learning · Computer Science 2018-11-09 Ivan Olier , Oghenejokpeme I. Orhobor , Joaquin Vanschoren , Ross D. King

Electronic phenotyping is the task of ascertaining whether an individual has a medical condition of interest by analyzing their medical record and is foundational in clinical informatics. Increasingly, electronic phenotyping is performed…

Machine Learning · Statistics 2019-01-08 Daisy Yi Ding , Chloé Simpson , Stephen Pfohl , Dave C. Kale , Kenneth Jung , Nigam H. Shah

Graph Neural Networks (GNNs) have gained traction in the complex domain of drug discovery because of their ability to process graph-structured data such as drug molecule models. This approach has resulted in a myriad of methods and models…

Machine Learning · Computer Science 2025-09-10 Katherine Berry , Liang Cheng