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Proteins are the basic building blocks of life. They usually perform functions by folding to a particular structure. Understanding the folding process could help the researchers to understand the functions of proteins and could also help to…

Computational Engineering, Finance, and Science · Computer Science 2015-10-21 Jianzhu Ma

Structural information about protein-protein interactions, often missing at the interactome scale, is important for mechanistic understanding of cells and rational discovery of therapeutics. Protein docking provides a computational…

Biomolecules · Quantitative Biology 2020-12-17 Yue Cao , Yang Shen

Identifying interactions between proteins is important to understand underlying biological processes. Extracting a protein-protein interaction (PPI) from the raw text is often very difficult. Previous supervised learning methods have used…

Quantitative Methods · Quantitative Biology 2018-08-10 Mahtab Ahmed , Jumayel Islam , Muhammad Rifayat Samee , Robert E. Mercer

This paper proposes a new topology optimization method that applies a convolutional neural network (CNN), which is one deep learning technique for topology optimization problems. Using this method, we acquire a structure with a little…

Machine Learning · Computer Science 2020-01-06 Yusuke Takahashi , Yoshiro Suzuki , Akira Todoroki

Kernel pruning methods have been proposed to speed up, simplify, and improve explanation of convolutional neural network (CNN) models. However, the effectiveness of a simplified model is often below the original one. In this letter, we…

Machine Learning · Computer Science 2021-08-19 D. Osaku , J. F. Gomes , A. X. Falcão

We propose a novel deep network structure called "Network In Network" (NIN) to enhance model discriminability for local patches within the receptive field. The conventional convolutional layer uses linear filters followed by a nonlinear…

Neural and Evolutionary Computing · Computer Science 2014-03-05 Min Lin , Qiang Chen , Shuicheng Yan

Many real-world applications can be modelled as complex networks, and such networks include the Internet, epidemic disease networks, transport networks, power grids, protein-folding structures and others. Network integrity and robustness…

Social and Information Networks · Computer Science 2020-03-11 Qian Li , San-Yang Liu , Xin-She Yang

Protein complexes conserved across species indicate processes that are core to cellular machinery (e.g. cell-cycle or DNA damage-repair complexes conserved across human and yeast). While numerous computational methods have been devised to…

Molecular Networks · Quantitative Biology 2013-10-24 Phi Vu Nguyen , Sriganesh Srihari , Hon Wai Leong

Numerical modeling errors are unavoidable in finite element analysis. The presence of model errors inherently reflects both model accuracy and uncertainty. To date there have been few methods for explicitly quantifying errors at points of…

Machine Learning · Computer Science 2024-11-19 Bozhou Zhuang , Sashank Rana , Brandon Jones , Danny Smyl

Principal component analysis (PCA) is largely adopted for chemical process monitoring and numerous PCA-based systems have been developed to solve various fault detection and diagnosis problems. Since PCA-based methods assume that the…

Machine Learning · Computer Science 2017-12-13 Haitao Zhao

To reduce memory footprint and run-time latency, techniques such as neural network pruning and binarization have been explored separately. However, it is unclear how to combine the best of the two worlds to get extremely small and efficient…

Computer Vision and Pattern Recognition · Computer Science 2018-12-12 Yinghao Xu , Xin Dong , Yudian Li , Hao Su

Accurate wireless channel estimation is critical for next-generation wireless systems, enabling precise precoding for effective user separation, reduced interference across cells, and high-resolution sensing, among other benefits.…

Signal Processing · Electrical Eng. & Systems 2026-03-03 Alireza Javid , Nuria González-Prelcic

With the successful application of deep learning in communications systems, deep neural networks are becoming the preferred method for signal classification. Although these models yield impressive results, they often come with high…

Machine Learning · Computer Science 2024-06-13 Yao Lu , Yutao Zhu , Yuqi Li , Dongwei Xu , Yun Lin , Qi Xuan , Xiaoniu Yang

Many systems, ranging from biological and engineering systems to social systems, can be modeled as directed networks, with links representing directed interaction between two nodes. To assess the importance of a node in a directed network,…

Physics and Society · Physics 2009-11-06 Naoki Masuda , Yoji Kawamura , Hiroshi Kori

The arc of drug discovery entails a multiparameter optimization problem spanning vast length scales. They key parameters range from solubility (angstroms) to protein-ligand binding (nanometers) to in vivo toxicity (meters). Through feature…

In order to identify a system (module) embedded in a dynamic network, one has to formulate a multiple-input estimation problem that necessitates certain nodes to be measured and included as predictor inputs. However, some of these nodes may…

Systems and Control · Electrical Eng. & Systems 2022-08-24 Karthik R. Ramaswamy , Giulio Bottegal , Paul M. J. Van den Hof

Understanding the morphological changes of primary neuronal cells induced by chemical compounds is essential for drug discovery. Using the data from a single high-throughput imaging assay, a classification model for predicting the…

Image and Video Processing · Electrical Eng. & Systems 2019-09-02 Andrey Kormilitzin , Xinyu Yang , William H. Stone , Caroline Woffindale , Francesca Nicholls , Elena Ribe , Alejo Nevado-Holgado , Noel Buckley

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

Identifying central nodes using closeness centrality is a critical task in analyzing large-scale complex networks, yet its decentralized computation remains challenging due to high communication overhead. Existing distributed approximation…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-12-15 Patrick D. Manya , Eugene M. Mbuyi , Gothy T. Ngoie , Jordan F. Masakuna

In multi-domain proteins, the domains are connected by a flexible unstructured region called as protein domain linker. The accurate demarcation of these linkers holds a key to understanding of their biochemical and evolutionary attributes.…

Computational Engineering, Finance, and Science · Computer Science 2012-11-26 Vivekanand Samant , Arvind Hulgeri , Alfonso Valencia , Ashish V. Tendulkar
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