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Predicting ATP-Protein Binding sites in genes is of great significance in the field of Biology and Medicine. The majority of research in this field has been conducted through time- and resource-intensive 'wet experiments' in laboratories.…

生物大分子 · 定量生物学 2024-02-06 Shreyas V , Swati Agarwal

Unravelling protein distributions within individual cells is key to understanding their function and state and indispensable to developing new treatments. Here we present the Hybrid subCellular Protein Localiser (HCPL), which learns from…

计算机视觉与模式识别 · 计算机科学 2022-09-20 Syed Sameed Husain , Eng-Jon Ong , Dmitry Minskiy , Mikel Bober-Irizar , Amaia Irizar , Miroslaw Bober

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…

生物大分子 · 定量生物学 2021-01-26 Stephan Eismann , Raphael J. L. Townshend , Nathaniel Thomas , Milind Jagota , Bowen Jing , Ron O. Dror

Protein engineering is an emerging field in biotechnology that has the potential to revolutionize various areas, such as antibody design, drug discovery, food security, ecology, and more. However, the mutational space involved is too vast…

生物大分子 · 定量生物学 2023-07-28 Yuchi Qiu , Guo-Wei Wei

Biological networks provide insight into the complex organization of biological processes in a cell at the system level. They are an effective tool for understanding the comprehensive map of functional interactions, finding the functional…

分子网络 · 定量生物学 2017-09-14 Somaye Hashemifar

State-of-the-art methods for protein-protein interaction (PPI) extraction are primarily feature-based or kernel-based by leveraging lexical and syntactic information. But how to incorporate such knowledge in the recent deep learning methods…

计算与语言 · 计算机科学 2017-06-08 Yifan Peng , Zhiyong Lu

Understanding how protein mutations affect protein-nucleic acid binding is critical for unraveling disease mechanisms and advancing therapies. Current experimental approaches are laborious, and computational methods remain limited in…

定量方法 · 定量生物学 2025-05-30 Xiang Liu , Junjie Wee , Guo-Wei Wei

We focus on Multimodal Machine Reading Comprehension (M3C) where a model is expected to answer questions based on given passage (or context), and the context and the questions can be in different modalities. Previous works such as RecipeQA…

计算机视觉与模式识别 · 计算机科学 2021-10-25 Pritish Sahu , Karan Sikka , Ajay Divakaran

Influenza poses a significant threat to public health, particularly among the elderly, young children, and people with underlying dis-eases. The manifestation of severe conditions, such as pneumonia, highlights the importance of preventing…

机器学习 · 计算机科学 2024-02-23 Yanhua Xu , Dominik Wojtczak

Identifying novel drug-target interactions (DTI) is a critical and rate limiting step in drug discovery. While deep learning models have been proposed to accelerate the identification process, we show that state-of-the-art models fail to…

Representation learning methods for heterogeneous networks produce a low-dimensional vector embedding for each node that is typically fixed for all tasks involving the node. Many of the existing methods focus on obtaining a static vector…

机器学习 · 计算机科学 2021-04-28 Ping Wang , Khushbu Agarwal , Colby Ham , Sutanay Choudhury , Chandan K. Reddy

While persistent homology is widely used for data shape analysis, persistent commutative algebra (PCA) has seen limited adoption in machine learning and data science. Unlike persistent homology, which delivers topological invariants in the…

交换代数 · 数学 2025-10-28 Mushal Zia , Faisal Suwayyid , Guo-Wei Wei

For protein sequence datasets, unlabeled data has greatly outpaced labeled data due to the high cost of wet-lab characterization. Recent deep-learning approaches to protein prediction have shown that pre-training on unlabeled data can yield…

机器学习 · 计算机科学 2020-12-02 Pascal Sturmfels , Jesse Vig , Ali Madani , Nazneen Fatema Rajani

Traditional vaccines against viruses are designed to target their surface proteins, i.e., antigens, which can trigger the immune system to produce specific antibodies to capture and neutralize the viruses. However, viruses often evolve…

种群与进化 · 定量生物学 2020-03-25 Rui Qiao , Ngoc Hieu Tran , Baozhen Shan , Ali Ghodsi , Ming Li

Many real-world systems involve higher-order interactions and thus demand complex models such as hypergraphs. For instance, a research article could have multiple collaborating authors, and therefore the co-authorship network is best…

社会与信息网络 · 计算机科学 2020-06-22 Tarun Kumar , K Darwin , Srinivasan Parthasarathy , Balaraman Ravindran

Protein function and dynamics are closely related to its sequence and structure. However prediction of protein function and dynamics from its sequence and structure is still a fundamental challenge in molecular biology. Protein…

生物大分子 · 定量生物学 2015-10-06 Zixuan Cang , Lin Mu , Kedi Wu , Kristopher Opron , Kelin Xia , Guo-Wei Wei

The study of cellular signalling pathways and their deregulation in disease states, such as cancer, is a large and extremely complex task. Indeed, these systems involve many parts and processes but are studied piecewise and their…

人工智能 · 计算机科学 2016-08-22 Adrien Basso-Blandin , Walter Fontana , Russ Harmer

Signaling proteins are an important topic in drug development due to the increased importance of finding fast, accurate and cheap methods to evaluate new molecular targets involved in specific diseases. The complexity of the protein…

Knowing the location of a protein within the cell is important for understanding its function, role in biological processes, and potential use as a drug target. Much progress has been made in developing computational methods that predict…

定量方法 · 定量生物学 2013-08-02 Ramanuja Simha , Hagit Shatkay

Background. Human aging is linked to many prevalent diseases. The aging process is highly influenced by genetic factors. Hence, it is important to identify human aging-related genes. We focus on supervised prediction of such genes. Gene…

分子网络 · 定量生物学 2020-04-28 Qi Li , Tijana Milenković