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The correct prediction of protein secondary structures is one of the key issues in predicting the correct protein folded shape, which is used for determining gene function. Existing methods make use of amino acids properties as indices to…

Quantitative Methods · Quantitative Biology 2017-05-01 Jian-Jun Shu , Kian-Yan Yong

How to effectively approximate real-valued parameters with binary codes plays a central role in neural network binarization. In this work, we reveal an important fact that binarizing different layers has a widely-varied effect on the…

Computer Vision and Pattern Recognition · Computer Science 2018-02-19 Lixue Zhuang , Yi Xu , Bingbing Ni , Hongteng Xu

We present a new approach to 3D object representation where a neural network encodes the geometry of an object directly into the weights and biases of a second 'mapping' network. This mapping network can be used to reconstruct an object by…

Machine Learning · Computer Science 2020-04-07 Eric Mitchell , Selim Engin , Volkan Isler , Daniel D Lee

Bayesian learning is a powerful learning framework which combines the external information of the data (background information) with the internal information (training data) in a logically consistent way in inference and prediction. By…

Machine Learning · Statistics 2026-02-11 Erdong Guo , David Draper

While there has been significant progress in evaluating and comparing different representations for learning on protein data, the role of surface-based learning approaches remains not well-understood. In particular, there is a lack of…

Machine Learning · Computer Science 2025-10-23 Vincent Mallet , Souhaib Attaiki , Yangyang Miao , Bruno Correia , Maks Ovsjanikov

We propose a neural network weight encoding method for network property prediction that utilizes set-to-set and set-to-vector functions to efficiently encode neural network parameters. Our approach is capable of encoding neural networks in…

Machine Learning · Computer Science 2025-01-15 Bruno Andreis , Soro Bedionita , Philip H. S. Torr , Sung Ju Hwang

Convolutional Neural Network is known as ConvNet have been extensively used in many complex machine learning tasks. However, hyperparameters optimization is one of a crucial step in developing ConvNet architectures, since the accuracy and…

Computer Vision and Pattern Recognition · Computer Science 2017-12-21 Pushparaja Murugan

Many machine learning applications use latent variable models to explain structure in data, whereby visible variables (= coordinates of the given datapoint) are explained as a probabilistic function of some hidden variables. Finding…

Machine Learning · Computer Science 2016-12-30 Sanjeev Arora , Rong Ge , Tengyu Ma , Andrej Risteski

Single layer feedforward networks with random weights are known for their non-iterative and fast training algorithms and are successful in a variety of classification and regression problems. A major drawback of these networks is that they…

Machine Learning · Computer Science 2020-09-25 Ajay M. Patrikar

Rapid progress in deep learning has spurred its application to bioinformatics problems including protein structure prediction and design. In classic machine learning problems like computer vision, progress has been driven by standardized…

Biomolecules · Quantitative Biology 2019-02-04 Mohammed AlQuraishi

Backpropagation with gradient descent is a common optimization strategy employed by most neural network architectures in machine learning. However, finding optimal hyperparameters to guide training has proven challenging. While it is widely…

Machine Learning · Computer Science 2026-05-20 Vy Bui , Hang Yu , Karthik Kantipudi , Ziv Yaniv , Stefan Jaeger

Proteins adopt multiple structural conformations to perform their diverse biological functions, and understanding these conformations is crucial for advancing drug discovery. Traditional physics-based simulation methods often struggle with…

Biomolecules · Quantitative Biology 2025-03-14 Jiarui Lu , Xiaoyin Chen , Stephen Zhewen Lu , Chence Shi , Hongyu Guo , Yoshua Bengio , Jian Tang

Exactly solvable neural network models with asymmetric weights are rare, and exact solutions are available only in some mean-field approaches. In this article we find exact analytical solutions of an asymmetric spin-glass-like model of…

Neurons and Cognition · Quantitative Biology 2017-02-16 Diego Fasoli , Anna Cattani , Stefano Panzeri

Visually scoring lung involvement in systemic sclerosis from CT scans plays an important role in monitoring progression, but its labor intensiveness hinders practical application. We proposed, therefore, an automatic scoring framework that…

Image and Video Processing · Electrical Eng. & Systems 2021-10-18 Jingnan Jia , Marius Staring , Irene Hernández-Girón , Lucia J. M. Kroft , Anne A. Schouffoer , Berend C. Stoel

In this research, we introduce an innovative three-network architecture that comprises an encoder-decoder framework with an attention mechanism. The architecture comprises a 1st-order-pre-trainer, a 2nd-order-improver, and a discriminator…

Computational Physics · Physics 2023-11-28 Jian-Nan Chen , Jun-Jie Zhang

Nonlinear Parametric Optimization Network (NLPOpt-Net) is an unsupervised learning architecture to solve constrained nonlinear programs (NLP). Given the structure of an NLP, it learns the parametric solution maps with guaranteed constraint…

Machine Learning · Computer Science 2026-05-04 Bimol Nath Roy , Rahul Golder , MM Faruque Hasan

For high-dimensional Gaussian data, we investigate theoretically how the features of a two-layer neural network adapt to the structure of the target function through a few large batch gradient descent steps, leading to an improvement in the…

Machine Learning · Statistics 2025-06-05 Yatin Dandi , Florent Krzakala , Bruno Loureiro , Luca Pesce , Ludovic Stephan

Information encoding in the nervous system is supported through the precise spike-timings of neurons; however, an understanding of the underlying processes by which such representations are formed in the first place remains unclear. Here we…

Neural and Evolutionary Computing · Computer Science 2015-12-01 Brian Gardner , Ioana Sporea , André Grüning

We propose a new algorithm to learn a one-hidden-layer convolutional neural network where both the convolutional weights and the outputs weights are parameters to be learned. Our algorithm works for a general class of (potentially…

Machine Learning · Computer Science 2018-06-05 Simon S. Du , Surbhi Goel

Similarity-preserving hashing is a widely-used method for nearest neighbour search in large-scale image retrieval tasks. For most existing hashing methods, an image is first encoded as a vector of hand-engineering visual features, followed…

Computer Vision and Pattern Recognition · Computer Science 2019-08-17 Hanjiang Lai , Yan Pan , Ye Liu , Shuicheng Yan
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