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Long-tailed problem has been an important topic in face recognition task. However, existing methods only concentrate on the long-tailed distribution of classes. Differently, we devote to the long-tailed domain distribution problem, which…

Computer Vision and Pattern Recognition · Computer Science 2020-04-01 Dong Cao , Xiangyu Zhu , Xingyu Huang , Jianzhu Guo , Zhen Lei

Previous studies have shown that leveraging domain index can significantly boost domain adaptation performance (arXiv:2007.01807, arXiv:2202.03628). However, such domain indices are not always available. To address this challenge, we first…

Machine Learning · Computer Science 2023-06-13 Zihao Xu , Guang-Yuan Hao , Hao He , Hao Wang

The idea that structural disorder might be a novel mechanism of protein interaction is widespread in the Literature, although the number of statistically significant structural studies supporting this is surprisingly low. At variance with…

Disordered Systems and Neural Networks · Physics 2021-03-01 Beatriz Seoane , Alessandra Carbone

Motivation: Exploring drug-protein interactions (DPIs) work as a pivotal step in drug discovery. The fast expansion of available biological data enables computational methods effectively assist in experimental methods. Among them, deep…

Machine Learning · Computer Science 2021-02-01 Yifan Wu , Min Gao , Min Zeng , Feiyang Chen , Min Li , Jie Zhang

Over the last few years, several computational techniques have been devised to recover protein complexes from the protein interaction (PPI) networks of organisms. These techniques model "dense" subnetworks within PPI networks as complexes.…

Computational Engineering, Finance, and Science · Computer Science 2013-01-04 Sriganesh Srihari , Hon Wai Leong

Software-intensive projects are specified and modeled using domain terminology. Knowledge of the domain terminology is necessary for performing many Software Engineering tasks such as impact analysis, compliance verification, and safety…

Software Engineering · Computer Science 2018-08-16 Jin L. C. Guo , Natawut Monaikul , Jane Cleland-Huang

Modeling the interaction between proteins and ligands and accurately predicting their binding structures is a critical yet challenging task in drug discovery. Recent advancements in deep learning have shown promise in addressing this…

Machine Learning · Computer Science 2024-01-10 Qizhi Pei , Kaiyuan Gao , Lijun Wu , Jinhua Zhu , Yingce Xia , Shufang Xie , Tao Qin , Kun He , Tie-Yan Liu , Rui Yan

Complexes of physically interacting proteins are one of the fundamental functional units responsible for driving key biological mechanisms within the cell. Their identification is therefore necessary not only to understand complex formation…

Computational Engineering, Finance, and Science · Computer Science 2012-11-27 Sriganesh Srihari , Hon Wai Leong

Identifying protein functional sites (PFSs) and protein-ligand interactions (PLIs) are critically important in understanding the protein function and the involved biochemical reactions. As large amount of unknown proteins are quickly…

Biomolecules · Quantitative Biology 2017-01-30 Dengming Ming , Min Han , Xiongbo An

Protein design is a fundamental challenge in biotechnology, aiming to design novel sequences with specific functions within the vast space of possible proteins. Recent advances in deep generative models have enabled function-based protein…

Machine Learning · Computer Science 2025-10-15 Nuowei Liu , Jiahao Kuang , Yanting Liu , Tao Ji , Changzhi Sun , Man Lan , Yuanbin Wu

Understanding how proteins structurally interact is crucial to modern biology, with applications in drug discovery and protein design. Recent machine learning methods have formulated protein-small molecule docking as a generative problem…

Predicting drug-target binding affinity (DTA) is essential for identifying potential therapeutic candidates in drug discovery. However, most existing models rely heavily on static protein structures, often overlooking the dynamic nature of…

Robotics · Computer Science 2025-05-20 Dan Luo , Jinyu Zhou , Le Xu , Sisi Yuan , Xuan Lin

Protein (receptor)--ligand interaction prediction is a critical component in computer-aided drug design, significantly influencing molecular docking and virtual screening processes. Despite the development of numerous scoring functions in…

Biomolecules · Quantitative Biology 2024-01-22 Haoyu Lin , Shiwei Wang , Jintao Zhu , Yibo Li , Jianfeng Pei , Luhua Lai

In recent years, due to the emergence of deep learning, face recognition has achieved exceptional success. However, many of these deep face recognition models perform relatively poorly in handling profile faces compared to frontal faces.…

Computer Vision and Pattern Recognition · Computer Science 2020-05-06 Fariborz Taherkhani , Veeru Talreja , Jeremy Dawson , Matthew C. Valenti , Nasser M. Nasrabadi

Numerous experiments demonstrate a high level of promiscuity and structural disorder in organismal proteomes. Here we ask the question what makes a protein promiscuous, i.e., prone to non-specific interactions, and structurally disordered.…

Biomolecules · Quantitative Biology 2011-05-10 Ariel Afek , Eugene I. Shakhnovich , David B. Lukatsky

Causality has been combined with machine learning to produce robust representations for domain generalization. Most existing methods of this type require massive data from multiple domains to identify causal features by cross-domain…

Machine Learning · Computer Science 2024-03-01 Yang Chen , Yitao Liang , Zhouchen Lin

Most approaches to prediction of protein function from primary structure are based on similarity between the query sequence and sequences of known function. This approach, however, disregards the occurrence of gene duplication (paralogy) or…

Populations and Evolution · Quantitative Biology 2014-04-03 Paulo Bandiera-Paiva , Jackson C. Lima , Marcelo R. S. Briones

Cold-start drug-target interaction (DTI) prediction focuses on interaction between novel drugs and proteins. Previous methods typically learn transferable interaction patterns between structures of drug and proteins to tackle it. However,…

Machine Learning · Computer Science 2025-10-07 Ziying Zhang , Yaqing Wang , Yuxuan Sun , Min Ye , Quanming Yao

With diverse presentation forgery methods emerging continually, detecting the authenticity of images has drawn growing attention. Although existing methods have achieved impressive accuracy in training dataset detection, they still perform…

Computer Vision and Pattern Recognition · Computer Science 2024-03-20 Yingxin Lai , Guoqing Yang Yifan He , Zhiming Luo , Shaozi Li

The capacity of proteins to interact specifically with one another underlies our conceptual understanding of how living systems function. Systems-level study of specificity in protein-protein interactions is complicated by the fact that the…

Biomolecules · Quantitative Biology 2009-11-13 Eric Deeds , orr Ashenberg , Jaline Gerardine , Eugene Shakhnovich