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Neural methods of molecule property prediction require efficient encoding of structure and property relationship to be accurate. Recent work using graph algorithms shows limited generalization in the latent molecule encoding space. We build…

Quantitative Methods · Quantitative Biology 2020-11-26 Prateeth Nayak , Andrew Silberfarb , Ran Chen , Tulay Muezzinoglu , John Byrnes

In the context of supervised statistical learning, it is typically assumed that the training set comes from the same distribution that draws the test samples. When this is not the case, the behavior of the learned model is unpredictable and…

Machine Learning · Computer Science 2022-05-12 Antonio-Javier Gallego , Jorge Calvo-Zaragoza , Robert B. Fisher

Self-supervised learning of convolutional neural networks can harness large amounts of cheap unlabeled data to train powerful feature representations. As surrogate task, we jointly address ordering of visual data in the spatial and temporal…

Computer Vision and Pattern Recognition · Computer Science 2018-07-31 Uta Büchler , Biagio Brattoli , Björn Ommer

Despite their growing popularity, data-driven models of real-world dynamical systems require lots of data. However, due to sensing limitations as well as privacy concerns, this data is not always available, especially in domains such as…

Machine Learning · Computer Science 2023-02-24 Hussain Kazmi , Pierre Pinson

Large language models are classically trained in stages: pretraining on raw text followed by post-training for instruction following and reasoning. However, this separation creates a fundamental limitation: many desirable behaviors such as…

We propose a novel unsupervised object localization method that allows us to explain the predictions of the model by utilizing self-supervised pre-trained models without additional finetuning. Existing unsupervised and self-supervised…

Computer Vision and Pattern Recognition · Computer Science 2023-09-11 Yeonghwan Song , Seokwoo Jang , Dina Katabi , Jeany Son

The supervised learning paradigm is limited by the cost - and sometimes the impracticality - of data collection and labeling in multiple domains. Self-supervised learning, a paradigm which exploits the structure of unlabeled data to create…

In semi-supervised representation learning frameworks, when the number of labelled data is very scarce, the quality and representativeness of these samples become increasingly important. Existing literature on semi-supervised learning…

Computer Vision and Pattern Recognition · Computer Science 2024-11-05 Shuvendu Roy , Ali Etemad

The goal of this paper is to investigate the connection between the performance gain that can be obtained by selftraining and the similarity between the corpora used in this approach. Self-training is a semi-supervised technique designed to…

Computation and Language · Computer Science 2016-01-14 Vincent Van Asch , Walter Daelemans

Recently, transfer learning and self-supervised learning have gained significant attention within the medical field due to their ability to mitigate the challenges posed by limited data availability, improve model generalisation, and reduce…

Computer Vision and Pattern Recognition · Computer Science 2025-07-29 Zehui Zhao , Laith Alzubaidi , Jinglan Zhang , Ye Duan , Usman Naseem , Yuantong Gu

We present a novel approach to leverage large unlabeled datasets by pre-training state-of-the-art deep neural networks on randomly-labeled datasets. Specifically, we train the neural networks to memorize arbitrary labels for all the samples…

Machine Learning · Computer Science 2018-11-06 Vinaychandran Pondenkandath , Michele Alberti , Sammer Puran , Rolf Ingold , Marcus Liwicki

How can we train models whose post-trained capabilities survive subsequent fine-tuning? Rather than focusing on downstream interventions to mitigate forgetting of upstream capabilities, we study how upstream training choices - that is, the…

Machine Learning · Computer Science 2026-05-14 Lawrence Feng , Gaurav R. Ghosal , Jacob Mitchell Springer , Ziqian Zhong , Aditi Raghunathan

A retrieval model should not only interpolate the training data but also extrapolate well to the queries that are different from the training data. While neural retrieval models have demonstrated impressive performance on ad-hoc search…

Information Retrieval · Computer Science 2022-08-05 Jingtao Zhan , Xiaohui Xie , Jiaxin Mao , Yiqun Liu , Jiafeng Guo , Min Zhang , Shaoping Ma

Artificial intelligence is transforming computational materials science, improving the prediction of material properties, and accelerating the discovery of novel materials. Recently, publicly available material data repositories have grown…

Despite the recent success on image classification, self-training has only achieved limited gains on structured prediction tasks such as neural machine translation (NMT). This is mainly due to the compositionality of the target space, where…

Computation and Language · Computer Science 2020-12-08 Minkai Xu , Mingxuan Wang , Zhouhan Lin , Hao Zhou , Weinan Zhang , Lei Li

While reliable data-driven decision-making hinges on high-quality labeled data, the acquisition of quality labels often involves laborious human annotations or slow and expensive scientific measurements. Machine learning is becoming an…

Machine Learning · Statistics 2024-03-01 Tijana Zrnic , Emmanuel J. Candès

In many prediction problems, we have extra information during training (for example, measurements that are expensive or slow to collect) that will not be available when the model is deployed. A common strategy is to first train a model that…

Machine Learning · Statistics 2026-05-25 Jiahao Shi , Omar Hagrass , Jason M. Klusowski

Pretraining has become a standard technique in computer vision and natural language processing, which usually helps to improve performance substantially. Previously, the most dominant pretraining method is transfer learning (TL), which uses…

Computer Vision and Pattern Recognition · Computer Science 2020-07-09 Xingyi Yang , Xuehai He , Yuxiao Liang , Yue Yang , Shanghang Zhang , Pengtao Xie

In this work, we provide a broad comparative analysis of strategies for pre-training audio understanding models for several tasks in the music domain, including labelling of genre, era, origin, mood, instrumentation, key, pitch, vocal…

Pretraining DNA language models (DNALMs) on the full human genome is resource-intensive, yet often considered necessary for strong downstream performance. Inspired by recent findings in NLP and long-context modeling, we explore an…

Genomics · Quantitative Biology 2025-06-24 Sohan Mupparapu , Parameswari Krishnamurthy , Ratish Puduppully