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A cascading system of hierarchical, artificial neural networks (named PRED-CLASS) is presented for the generalized classification of proteins into four distinct classes-transmembrane, fibrous, globular, and mixed-from information solely…

定量方法 · 定量生物学 2009-02-19 Claude Pasquier , Vasilis Promponas , Stavros Hamodrakas

Multiple Sequences Alignment (MSA) of biological sequences is a fundamental problem in computational biology due to its critical significance in wide ranging applications including haplotype reconstruction, sequence homology, phylogenetic…

分布式、并行与集群计算 · 计算机科学 2009-05-13 Fahad Saeed , Ashfaq Khokhar

Motivation: A major challenge in the development of machine learning based methods in computational biology is that data may not be accurately labeled due to the time and resources required for experimentally annotating properties of…

机器学习 · 计算机科学 2017-11-15 Amina Asif , Wajid Arshad Abbasi , Farzeen Munir , Asa Ben-Hur , Fayyaz ul Amir Afsar Minhas

Protein structure prediction is a challenging and unsolved problem in computer science. Proteins are the sequence of amino acids connected together by single peptide bond. The combinations of the twenty primary amino acids are the…

计算工程、金融与科学 · 计算机科学 2015-10-12 Mahmood A. Rashid , Firas Khatib , Abdul Sattar

The goal of protein representation learning is to extract knowledge from protein databases that can be applied to various protein-related downstream tasks. Although protein sequence, structure, and function are the three key modalities for…

生物大分子 · 定量生物学 2024-05-14 Eunji Ko , Seul Lee , Minseon Kim , Dongki Kim

Two proteins are homologous if they have a common evolutionary origin, and the binary classification problem is to identify proteins in a candidate set that are homologous to a particular native protein. The feature (explanatory) variables…

机器学习 · 统计学 2019-09-11 Jabed H Tomal , William J Welch , Ruben H Zamar

Clustering of proteins is of interest in cancer cell biology. This article proposes a hierarchical Bayesian model for protein (variable) clustering hinging on correlation structure. Starting from a multivariate normal likelihood, we enforce…

统计计算 · 统计学 2022-02-09 Riddhi Pratim Ghosh , Arnab Kumar Maity , Mohsen Pourahmadi , Bani K. Mallick

The Gene or DNA sequence in every cell does not control genetic properties on its own; Rather, this is done through translation of DNA into protein and subsequent formation of a certain 3D structure. The biological function of a protein is…

计算工程、金融与科学 · 计算机科学 2019-05-30 Leila Khalatbari , Mohammad Reza Kangavari , Saeid Hosseini , Hongzhi Yin , Ngai-Man Cheung

The unsupervised anomaly localization task faces the challenge of missing anomaly sample training, detecting multiple types of anomalies, and dealing with the proportion of the area of multiple anomalies. A separate teacher-student feature…

计算机视觉与模式识别 · 计算机科学 2022-12-14 Chao Hu , Shengxin Lai

The field of protein folding research has been greatly advanced by deep learning methods, with AlphaFold2 (AF2) demonstrating exceptional performance and atomic-level precision. As co-evolution is integral to protein structure prediction,…

定量方法 · 定量生物学 2023-06-06 Le Zhang , Jiayang Chen , Tao Shen , Yu Li , Siqi Sun

Analyzing the relation between a set of biological sequences can help to identify and understand the evolutionary history of these sequences and the functional relations among them. Multiple Sequence Alignment (MSA) is the main obstacle to…

定量方法 · 定量生物学 2017-08-07 Sara Shehab , Sameh Shohdy , Arabi E. Keshk

We develop a stochastic algorithm for independent component analysis that incorporates multi-trial supervision, which is available in many scientific contexts. The method blends a proximal gradient-type algorithm in the space of invertible…

机器学习 · 计算机科学 2025-08-29 Ronak Mehta , Mateus Piovezan Otto , Noah Stanis , Azadeh Yazdan-Shahmorad , Zaid Harchaoui

Proteins typically exist in complexes, interacting with other proteins or biomolecules to perform their specific biological roles. Research on single-chain protein modeling has been extensively and deeply explored, with advancements seen in…

机器学习 · 计算机科学 2025-09-09 Ruizhe Chen , Dongyu Xue , Xiangxin Zhou , Zaixiang Zheng , Xiangxiang Zeng , Quanquan Gu

Evolutionary modeling applications are the best way to provide full information to support in-depth understanding of evaluation of organisms. These applications mainly depend on identifying the evolutionary history of existing organisms and…

计算工程、金融与科学 · 计算机科学 2018-06-01 Sara Shehab , Sameh Abdulah , Arabi E. Keshk

Structure and function in nanoscale atomistic assemblies are tightly coupled, and every atom with its specific position and even every electron will have a decisive effect on the electronic structure, and hence, on the molecular properties.…

化学物理 · 物理学 2024-02-21 Katja-Sophia Csizi , Markus Reiher

We theorize that phylogenetic profiles provide a quantitative method that can relate the structural and functional properties of proteins, as well as their evolutionary relationships. A key feature of phylogenetic profiles is the…

定量方法 · 定量生物学 2009-11-04 Yoojin Hong , Jaewoo Kang , Dongwon Lee , Randen L. Patterson , Damian B. van Rossum

Classification is one of the most important tasks in Machine Learning (ML) and with recent advancements in artificial intelligence (AI) it is important to find efficient ways to implement it. Generally, the choice of classification…

机器学习 · 计算机科学 2023-12-27 Anuja Dixit , Shreya Byreddy , Guanqun Song , Ting Zhu

Protein function depends on both protein structure and amino acid (aa) sequence. Here we show that modular features of both structure and function can be quantified from the aa sequence alone for the amyloid 770 aa precursor protein A4.…

生物大分子 · 定量生物学 2014-03-06 J. C. Phillips

The conformations available to polypeptides are determined by the interatomic forces acting on the peptide units, whereby backbone torsion angles are restricted as described by the Ramachandran plot. Although typical proteins are composed…

生物大分子 · 定量生物学 2013-02-11 Anil Korkut , Wayne A Hendrickson

As protein therapeutics play an important role in almost all medical fields, numerous studies have been conducted on proteins using artificial intelligence. Artificial intelligence has enabled data driven predictions without the need for…

定量方法 · 定量生物学 2023-03-30 Myeonghun Lee , Kyoungmin Min