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Statistical learning algorithms are finding more and more applications in science and technology. Atomic-scale modeling is no exception, with machine learning becoming commonplace as a tool to predict energy, forces and properties of…

Chemical Physics · Physics 2020-12-09 Félix Musil , Michele Ceriotti

Molecular representation is a critical element in our understanding of the physical world and the foundation for modern molecular machine learning. Previous molecular machine learning models have employed strings, fingerprints, global…

Machine Learning · Computer Science 2025-05-28 Daniil A. Boiko , Thiago Reschützegger , Benjamin Sanchez-Lengeling , Samuel M. Blau , Gabe Gomes

It's a meaningful and attractive topic to build a general and inclusive segmentation model that can recognize more categories in various scenarios. A straightforward way is to combine the existing fragmented segmentation datasets and train…

Computer Vision and Pattern Recognition · Computer Science 2023-02-28 Qiang Zhou , Yuang Liu , Chaohui Yu , Jingliang Li , Zhibin Wang , Fan Wang

Statistical Shape Modeling (SSM) effectively analyzes anatomical variations within populations but is limited by the need for manual localization and segmentation, which relies on scarce medical expertise. Recent advances in deep learning…

Computer Vision and Pattern Recognition · Computer Science 2024-07-10 Janmesh Ukey , Tushar Kataria , Shireen Y. Elhabian

The integration of machine learning techniques in materials discovery has become prominent in materials science research and has been accompanied by an increasing trend towards open-source data and tools to propel the field. Despite the…

Materials Science · Physics 2026-05-27 Daniel Persaud , Logan Ward , Jason Hattrick-Simpers

The development of materials science is undergoing a shift from empirical approaches to data-driven and algorithm-oriented research paradigm. The state-of-the-art platforms are confined to inorganic crystals, with limited chemical space,…

Materials Science · Physics 2025-07-08 Jifeng Wang , Jiazhe Ju , Ying Wang

Deep learning has demonstrated remarkable success in medical image segmentation and computer-aided diagnosis. In particular, numerous advanced methods have achieved state-of-the-art performance in brain tumor segmentation from MRI scans.…

Computer Vision and Pattern Recognition · Computer Science 2025-06-24 Xiaoyu Shi , Rahul Kumar Jain , Yinhao Li , Ruibo Hou , Jingliang Cheng , Jie Bai , Guohua Zhao , Lanfen Lin , Rui Xu , Yen-wei Chen

Training multimodal large language models (MLLMs) for video understanding requires large-scale annotated data spanning diverse tasks such as object counting, question answering, and segmentation. However, collecting and annotating…

Computer Vision and Pattern Recognition · Computer Science 2026-04-15 Tanzila Rahman , Renjie Liao , Leonid Sigal

Floorplanning for systems-on-a-chip (SoCs) and its sub-systems is a crucial and non-trivial step of the physical design flow. It represents a difficult combinatorial optimization problem. A typical large scale SoC with 120 partitions…

Hardware Architecture · Computer Science 2024-08-05 Uday Mallappa , Hesham Mostafa , Mikhail Galkin , Mariano Phielipp , Somdeb Majumdar

Lecture slide presentations, a sequence of pages that contain text and figures accompanied by speech, are constructed and presented carefully in order to optimally transfer knowledge to students. Previous studies in multimedia and…

Artificial Intelligence · Computer Science 2022-08-18 Dong Won Lee , Chaitanya Ahuja , Paul Pu Liang , Sanika Natu , Louis-Philippe Morency

Large datasets are the cornerstone of recent advances in computer vision using deep learning. In contrast, existing human motion capture (mocap) datasets are small and the motions limited, hampering progress on learning models of human…

Computer Vision and Pattern Recognition · Computer Science 2019-04-09 Naureen Mahmood , Nima Ghorbani , Nikolaus F. Troje , Gerard Pons-Moll , Michael J. Black

Remote sensing scene classification (RSSC) is a critical task with diverse applications in land use and resource management. While unimodal image-based approaches show promise, they often struggle with limitations such as high intra-class…

Computer Vision and Pattern Recognition · Computer Science 2024-12-04 Jinjin Cai , Kexin Meng , Baijian Yang , Gang Shao

Efficient and scalable non-parametric or semi-parametric regression analysis and density estimation are of crucial importance to the fields of statistics and machine learning. However, available methods are limited in their ability to…

Machine Learning · Computer Science 2026-03-23 Zeyu Ding , Katja Ickstadt , Nadja Klein , Alexander Munteanu , Simon Omlor

Measurements are fundamental to knowledge creation in science, enabling consistent sharing of findings and serving as the foundation for scientific discovery. As machine learning systems increasingly transform scientific fields, the…

Materials Science · Physics 2025-05-07 Nawaf Alampara , Mara Schilling-Wilhelmi , Kevin Maik Jablonka

Deep learning techniques for point clouds have achieved strong performance on a range of 3D vision tasks. However, it is costly to annotate large-scale point sets, making it critical to learn generalizable representations that can transfer…

Computer Vision and Pattern Recognition · Computer Science 2022-04-18 Chao Huang , Zhangjie Cao , Yunbo Wang , Jianmin Wang , Mingsheng Long

Multi-source stationary computed tomography (MSS-CT) offers significant advantages in medical and industrial applications due to its gantry-less scan architecture and/or capability of simultaneous multi-source emission. However, the lack of…

Medical Physics · Physics 2025-01-20 Yingxian Xia , Zhiqiang Chen , Li Zhang , Yuxiang Xing , Hewei Gao

One of the key factors of enabling machine learning models to comprehend and solve real-world tasks is to leverage multimodal data. Unfortunately, annotation of multimodal data is challenging and expensive. Recently, self-supervised…

Computer Vision and Pattern Recognition · Computer Science 2020-12-11 Elad Amrani , Rami Ben-Ari , Daniel Rotman , Alex Bronstein

We introduce a machine-learning (ML) framework for high-throughput benchmarking of diverse representations of chemical systems against datasets of materials and molecules. The guiding principle underlying the benchmarking approach is to…

Machine Learning · Computer Science 2021-12-07 Carl Poelking , Felix A. Faber , Bingqing Cheng

In condensed matter physics and materials science, predicting material properties necessitates understanding intricate many-body interactions. Conventional methods such as density functional theory (DFT) and molecular dynamics (MD) often…

Materials Science · Physics 2023-11-17 Lalit Yadav

Medical image segmentation annotations exhibit variations among experts due to the ambiguous boundaries of segmented objects and backgrounds in medical images. Although using multiple annotations for each image in the fully-supervised has…

Computer Vision and Pattern Recognition · Computer Science 2023-11-20 Shuai Wang , Tengjin Weng , Jingyi Wang , Yang Shen , Zhidong Zhao , Yixiu Liu , Pengfei Jiao , Zhiming Cheng , Yaqi Wang