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Data classification techniques partition the data or feature space into smaller sub-spaces, each corresponding to a specific class. To classify into subspaces, physical features e.g., distance and distributions are utilized. This approach…

Machine Learning · Computer Science 2025-03-11 Josimar Chire , Khalid Mahmood , Zhao Liang

Protein structural classification (PSC) is a supervised problem of assigning proteins into pre-defined structural (e.g., CATH or SCOPe) classes based on the proteins' sequence or 3D structural features. We recently proposed PSC approaches…

Molecular Networks · Quantitative Biology 2021-05-18 Khalique Newaz , Jacob Piland , Patricia L. Clark , Scott J. Emrich , Jun Li , Tijana Milenkovic

Lung diseases including infections such as Pneumonia, Tuberculosis, and novel Coronavirus (COVID-19), together with Lung Cancer are significantly widespread and are, typically, considered life threatening. In particular, lung cancer is…

Image and Video Processing · Electrical Eng. & Systems 2020-08-17 Parnian Afshar , Farnoosh Naderkhani , Anastasia Oikonomou , Moezedin Javad Rafiee , Arash Mohammadi , Konstantinos N. Plataniotis

The potential of deep learning has been recognized in the protein structure prediction community for some time, and became indisputable after CASP13. In CASP14, deep learning has boosted the field to unanticipated levels reaching…

Biomolecules · Quantitative Biology 2021-09-14 Elodie Laine , Stephan Eismann , Arne Elofsson , Sergei Grudinin

This paper extensively evaluates the vulnerability of capsule networks to different adversarial attacks. Recent work suggests that these architectures are more robust towards adversarial attacks than other neural networks. However, our…

Machine Learning · Computer Science 2019-06-11 Felix Michels , Tobias Uelwer , Eric Upschulte , Stefan Harmeling

Capsule networks excel in understanding spatial relationships in 2D data for vision related tasks. Even though they are not designed to capture 1D temporal relationships, with TimeCaps we demonstrate that given the ability, capsule networks…

This paper presents a study of automatic design of neural network architectures for skeleton-based action recognition. Specifically, we encode a skeleton-based action instance into a tensor and carefully define a set of operations to build…

Computer Vision and Pattern Recognition · Computer Science 2020-10-30 Haoyuan Zhang , Yonghong Hou , Pichao Wang , Zihui Guo , Wanqing Li

In a recurrent setting, conventional approaches to neural architecture search find and fix a general model for all data samples and time steps. We propose a novel algorithm that can dynamically search for the structure of cells in a…

Machine Learning · Computer Science 2019-05-28 Xin Qian , Matthew Kennedy , Diego Klabjan

In recent years, Convolutional Neural Networks (CNN) have proven to be efficient analysis tools for processing point clouds, e.g., for reconstruction, segmentation and classification. In this paper, we focus on the classification of edges…

Learning from 3D protein structures has gained wide interest in protein modeling and structural bioinformatics. Unfortunately, the number of available structures is orders of magnitude lower than the training data sizes commonly used in…

Biomolecules · Quantitative Biology 2022-06-01 Pedro Hermosilla , Timo Ropinski

Biological and cellular systems are often modeled as graphs in which vertices represent objects of interest (genes, proteins, drugs) and edges represent relational ties among these objects (binds-to, interacts-with, regulates). This…

Machine Learning · Statistics 2017-03-16 Jose Lugo-Martinez , Predrag Radivojac

Networks can be highly complex systems with numerous interconnected components and interactions. Granular computing offers a framework to manage this complexity by decomposing networks into smaller, more manageable components, or granules.…

Social and Information Networks · Computer Science 2025-03-06 Hibba Arshad , Imran Javaid

We consider representation learning for proteins with 3D structures. We build 3D graphs based on protein structures and develop graph networks to learn their representations. Depending on the levels of details that we wish to capture,…

Machine Learning · Computer Science 2023-03-07 Limei Wang , Haoran Liu , Yi Liu , Jerry Kurtin , Shuiwang Ji

Many text classification applications require models with satisfying performance as well as good interpretability. Traditional machine learning methods are easy to interpret but have low accuracies. The development of deep learning models…

Computation and Language · Computer Science 2020-06-02 Zhengyang Wang , Xia Hu , Shuiwang Ji

Synthetic Aperture Radar (SAR) constitutes a fundamental asset for wide-areas monitoring with high-resolution requirements. The first SAR sensors have given rise to coarse coastal and maritime monitoring applications, including oil spill,…

Image and Video Processing · Electrical Eng. & Systems 2019-10-15 Leonardo De Laurentiis , Andrea Pomente , Fabio Del Frate , Giovanni Schiavon

A fundamental goal of research in molecular biology is to understand protein structure. Protein crystallography is currently the most successful method for determining the three-dimensional (3D) conformation of a protein, yet it remains…

Artificial Intelligence · Computer Science 2014-11-17 L. Leherte , J. Glasgow , K. Baxter , E. Steeg , S. Fortier

Molecule property prediction is a fundamental problem for computer-aided drug discovery and materials science. Quantum-chemical simulations such as density functional theory (DFT) have been widely used for calculating the molecule…

Machine Learning · Computer Science 2019-11-26 Hiroyuki Shindo , Yuji Matsumoto

We represent 3D shape by structured 2D representations of fixed length making it feasible to apply well investigated 2D convolutional neural networks (CNN) for both discriminative and geometric tasks on 3D shapes. We first provide a general…

Computer Vision and Pattern Recognition · Computer Science 2023-08-14 Kripasindhu Sarkar , Elizabeth Mathews , Didier Stricker

We propose an interpretable Capsule Network, iCaps, for image classification. A capsule is a group of neurons nested inside each layer, and the one in the last layer is called a class capsule, which is a vector whose norm indicates a…

Computer Vision and Pattern Recognition · Computer Science 2020-08-21 Dahuin Jung , Jonghyun Lee , Jihun Yi , Sungroh Yoon

In healthcare, accurately classifying medical images is vital, but conventional methods often hinge on medical data with a consistent grid structure, which may restrict their overall performance. Recent medical research has been focused on…

Computer Vision and Pattern Recognition · Computer Science 2023-06-06 Kishore Babu Nampalle , Pradeep Singh , Vivek Narayan Uppala , Sumit Gangwar , Rajesh Singh Negi , Balasubramanian Raman