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Protein structural bioinformatics: An overview
V de Almeida Paiva, I de Souza Gomes… - Computers in Biology …, 2022 - Elsevier
Proteins play a crucial role in organisms in nature. They are able to perform structural,
catalytic, transport and defense functions in cells, among others. We understand that a …
catalytic, transport and defense functions in cells, among others. We understand that a …
Proteins and their interacting partners: An introduction to protein–ligand binding site prediction methods
Elucidating the biological and biochemical roles of proteins, and subsequently determining
their interacting partners, can be difficult and time consuming using in vitro and/or in vivo …
their interacting partners, can be difficult and time consuming using in vitro and/or in vivo …
PREvaIL, an integrative approach for inferring catalytic residues using sequence, structural, and network features in a machine-learning framework
Determining the catalytic residues in an enzyme is critical to our understanding the
relationship between protein sequence, structure, function, and enhancing our ability to …
relationship between protein sequence, structure, function, and enhancing our ability to …
Analysis of protein-ligand interactions of SARS-Cov-2 against selective drug using deep neural networks
N Yuvaraj, K Srihari, S Chandragandhi… - Big Data Mining and …, 2021 - ieeexplore.ieee.org
In recent time, data analysis using machine learning accelerates optimized solutions on
clinical healthcare systems. The machine learning methods greatly offer an efficient …
clinical healthcare systems. The machine learning methods greatly offer an efficient …
High precision protein functional site detection using 3D convolutional neural networks
Motivation Accurate annotation of protein functions is fundamental for understanding
molecular and cellular physiology. Data-driven methods hold promise for systematically …
molecular and cellular physiology. Data-driven methods hold promise for systematically …
eHSCPr discriminating the cell identity involved in endothelial to hematopoietic transition
Abstract Motivation Hematopoietic stem cells (HSCs) give rise to all blood cells and play a
vital role throughout the whole lifespan through their pluripotency and self-renewal …
vital role throughout the whole lifespan through their pluripotency and self-renewal …
Exploring the potential of 3D Zernike descriptors and SVM for protein–protein interface prediction
Background The correct determination of protein–protein interaction interfaces is important
for understanding disease mechanisms and for rational drug design. To date, several …
for understanding disease mechanisms and for rational drug design. To date, several …
GRaSP: a graph-based residue neighborhood strategy to predict binding sites
Motivation The discovery of protein–ligand-binding sites is a major step for elucidating
protein function and for investigating new functional roles. Detecting protein–ligand-binding …
protein function and for investigating new functional roles. Detecting protein–ligand-binding …
Computational methods and tools for binding site recognition between proteins and small molecules: from classical geometrical approaches to modern machine …
In the current “genomic era” the number of identified genes is growing exponentially.
However, the biological function of a large number of the corresponding proteins is still …
However, the biological function of a large number of the corresponding proteins is still …
GASS-WEB: a web server for identifying enzyme active sites based on genetic algorithms
Enzyme active sites are important and conserved functional regions of proteins whose
identification can be an invaluable step toward protein function prediction. Most of the …
identification can be an invaluable step toward protein function prediction. Most of the …