English
Related papers

Related papers: A Semi-Supervised Approach for Automatic Crystal S…

200 papers

In many machine learning applications, labeling datasets can be an arduous and time-consuming task. Although research has shown that semi-supervised learning techniques can achieve high accuracy with very few labels within the field of…

Computer Vision and Pattern Recognition · Computer Science 2023-06-07 Evelyn J. Mannix , Howard D. Bondell

We consider semi-supervised binary classification for applications in which data points are naturally grouped (e.g., survey responses grouped by state) and the labeled data is biased (e.g., survey respondents are not representative of the…

Machine Learning · Statistics 2022-12-08 Daniel Zeiberg , Shantanu Jain , Predrag Radivojac

Self-supervised contrastive representation learning has proved incredibly successful in the vision and natural language domains, enabling state-of-the-art performance with orders of magnitude less labeled data. However, such methods are…

Machine Learning · Computer Science 2022-03-17 Dara Bahri , Heinrich Jiang , Yi Tay , Donald Metzler

Crystal structure determination from powder diffraction patterns is a complex challenge in materials science, often requiring extensive expertise and computational resources. This study introduces DiffractGPT, a generative pre-trained…

Materials Science · Physics 2025-08-13 Kamal Choudhary

In addressing the challenge of Crystal Structure Prediction (CSP), symmetry-aware deep learning models, particularly diffusion models, have been extensively studied, which treat CSP as a conditional generation task. However, ensuring…

Materials Science · Physics 2025-12-09 Peijia Lin , Pin Chen , Rui Jiao , Qing Mo , Jianhuan Cen , Wenbing Huang , Yang Liu , Dan Huang , Yutong Lu

Fully-supervised category-level pose estimation aims to determine the 6-DoF poses of unseen instances from known categories, requiring expensive mannual labeling costs. Recently, various self-supervised category-level pose estimation…

Computer Vision and Pattern Recognition · Computer Science 2024-03-20 Jingtao Sun , Yaonan Wang , Mingtao Feng , Chao Ding , Mike Zheng Shou , Ajmal Saeed Mian

Semi-supervised learning (SSL) is a common approach to learning predictive models using not only labeled examples, but also unlabeled examples. While SSL for the simple tasks of classification and regression has received a lot of attention…

Machine Learning · Computer Science 2024-04-02 Jurica Levatić , Michelangelo Ceci , Dragi Kocev , Sašo Džeroski

Automated semantic segmentation of cell nuclei in microscopic images is crucial for disease diagnosis and tissue microenvironment analysis. Nonetheless, this task presents challenges due to the complexity and heterogeneity of cells. While…

Image and Video Processing · Electrical Eng. & Systems 2023-08-10 Zhuchen Shao , Sourya Sengupta , Hua Li , Mark A. Anastasio

Electron backscatter diffraction is a widely used technique for nano- to micro-scale analysis of crystal structure and orientation. Backscatter patterns produced by an alloy solid solution matrix and its ordered superlattice exhibit only…

Materials Science · Physics 2020-10-13 Thomas P McAuliffe , David Dye , T Ben Britton

Supervised contour detection methods usually require many labeled training images to obtain satisfactory performance. However, a large set of annotated data might be unavailable or extremely labor intensive. In this paper, we investigate…

Computer Vision and Pattern Recognition · Computer Science 2016-05-18 Zizhao Zhang , Fuyong Xing , Xiaoshuang Shi , Lin Yang

Semi-supervised learning is highly useful in common scenarios where labeled data is scarce but unlabeled data is abundant. The graph (or nonlocal) Laplacian is a fundamental smoothing operator for solving various learning tasks. For…

Computer Vision and Pattern Recognition · Computer Science 2023-04-20 Or Streicher , Guy Gilboa

The ever-increasing size of modern data sets combined with the difficulty of obtaining label information has made semi-supervised learning one of the problems of significant practical importance in modern data analysis. We revisit the…

Machine Learning · Computer Science 2014-11-06 Diederik P. Kingma , Danilo J. Rezende , Shakir Mohamed , Max Welling

X-ray diffraction (XRD) data acquisition and analysis is among the most time-consuming steps in the development cycle of novel thin-film materials. We propose a machine-learning-enabled approach to predict crystallographic dimensionality…

Domain-specific image collections present potential value in various areas of science and business but are often not curated nor have any way to readily extract relevant content. To employ contemporary supervised image analysis methods on…

Machine Learning · Computer Science 2020-03-10 Sara Mousavi , Dylan Lee , Tatianna Griffin , Dawnie Steadman , Audris Mockus

Crystal Structure Prediction (CSP) is crucial in various scientific disciplines. While CSP can be addressed by employing currently-prevailing generative models (e.g. diffusion models), this task encounters unique challenges owing to the…

Materials Science · Physics 2024-03-08 Rui Jiao , Wenbing Huang , Peijia Lin , Jiaqi Han , Pin Chen , Yutong Lu , Yang Liu

Machine learning techniques have successfully been used to extract structural information such as the crystal space group from powder X-ray diffractograms. However, training directly on simulated diffractograms from databases such as the…

Materials Science · Physics 2023-10-12 Henrik Schopmans , Patrick Reiser , Pascal Friederich

Modern data analysis pipelines are becoming increasingly complex due to the presence of multi-view information sources. While graphs are effective in modeling complex relationships, in many scenarios a single graph is rarely sufficient to…

Machine Learning · Statistics 2019-04-02 Uday Shankar Shanthamallu , Jayaraman J. Thiagarajan , Huan Song , Andreas Spanias

Multi-technique high resolution X-ray mapping enhanced by the recent advent of 4th generation synchrotron facilities can produce colossal datasets, challenging traditional analysis methods. Such difficulty is clearly materialized when…

We present a supervised learning framework of training generative models for density estimation. Generative models, including generative adversarial networks, normalizing flows, variational auto-encoders, are usually considered as…

Machine Learning · Computer Science 2023-10-24 Yanfang Liu , Minglei Yang , Zezhong Zhang , Feng Bao , Yanzhao Cao , Guannan Zhang

During the last ten years, a considerable amount of effort has been made to develop algorithms for automatic classification of variable stars. That has been primarily achieved by applying machine learning methods to photometric datasets…

Instrumentation and Methods for Astrophysics · Physics 2018-01-31 Lucas Valenzuela , Karim Pichara