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Deep learning is catalyzing a scientific revolution fueled by big data, accessible toolkits, and powerful computational resources, impacting many fields including protein structural modeling. Protein structural modeling, such as predicting…

Biomolecules · Quantitative Biology 2020-07-17 Wenhao Gao , Sai Pooja Mahajan , Jeremias Sulam , Jeffrey J. Gray

This paper proposes a paradigm of uncertainty injection for training deep learning model to solve robust optimization problems. The majority of existing studies on deep learning focus on the model learning capability, while assuming the…

Machine Learning · Computer Science 2023-02-28 Wei Cui , Wei Yu

Today, intelligent systems that offer artificial intelligence capabilities often rely on machine learning. Machine learning describes the capacity of systems to learn from problem-specific training data to automate the process of analytical…

Artificial Intelligence · Computer Science 2021-04-15 Christian Janiesch , Patrick Zschech , Kai Heinrich

Decision-making in complex systems often relies on machine learning models, yet highly accurate models such as XGBoost and neural networks can obscure the reasoning behind their predictions. In operations research applications,…

Machine Learning · Computer Science 2025-02-28 Gaurav Arwade , Sigurdur Olafsson

While interests in tabular deep learning has significantly grown, conventional tree-based models still outperform deep learning methods. To narrow this performance gap, we explore the innovative retrieval mechanism, a methodology that…

Machine Learning · Computer Science 2023-11-14 Felix den Breejen , Sangmin Bae , Stephen Cha , Tae-Young Kim , Seoung Hyun Koh , Se-Young Yun

Modeling the structure of coherent texts is a key NLP problem. The task of coherently organizing a given set of sentences has been commonly used to build and evaluate models that understand such structure. We propose an end-to-end…

Computation and Language · Computer Science 2017-12-25 Lajanugen Logeswaran , Honglak Lee , Dragomir Radev

Deep Learning models have achieved remarkable success. Training them is often accelerated by building on top of pre-trained models which poses the risk of perpetuating encoded biases. Here, we investigate biases in the representations of…

Computer Vision and Pattern Recognition · Computer Science 2025-06-09 Valerie Krug , Sebastian Stober

With the availability of large databases and recent improvements in deep learning methodology, the performance of AI systems is reaching or even exceeding the human level on an increasing number of complex tasks. Impressive examples of this…

Artificial Intelligence · Computer Science 2017-08-29 Wojciech Samek , Thomas Wiegand , Klaus-Robert Müller

The dominant approach in probing neural networks for linguistic properties is to train a new shallow multi-layer perceptron (MLP) on top of the model's internal representations. This approach can detect properties encoded in the model, but…

Computation and Language · Computer Science 2021-04-09 Steven Cao , Victor Sanh , Alexander M. Rush

The success of machine learning algorithms generally depends on data representation, and we hypothesize that this is because different representations can entangle and hide more or less the different explanatory factors of variation behind…

Machine Learning · Computer Science 2014-04-24 Yoshua Bengio , Aaron Courville , Pascal Vincent

In this paper we investigate a variety of deep learning strategies for solving inverse problems. We classify existing deep learning solutions for inverse problems into three categories of Direct Mapping, Data Consistency Optimizer, and Deep…

Computer Vision and Pattern Recognition · Computer Science 2021-11-16 Shima Kamyab , Zohreh Azimifar , Rasool Sabzi , Paul Fieguth

The unprecedented pace of machine learning research has lead to incredible advances, but also poses hard challenges. At present, the field lacks strong theoretical underpinnings, and many important achievements stem from ad hoc design…

Machine Learning · Computer Science 2024-10-16 Francesco Riccardo Crescenzi

In recent years, there has been considerable innovation in the world of predictive methodologies. This is evident by the relative domination of machine learning approaches in various classification competitions. While these algorithms have…

Machine Learning · Statistics 2020-10-12 Barinder Thind , Kevin Multani , Jiguo Cao

Despite their great success, neural networks still remain as black-boxes due to the lack of interpretability. Here we propose a new analyzing method, namely the weight pathway analysis (WPA), to make them transparent. We consider weights in…

Machine Learning · Computer Science 2022-08-09 Sihan Feng , Yong Zhang , Fuming Wang , Hong Zhao

Deep learning has become the dominant approach for creating high capacity, scalable models across diverse data modalities. However, because these models rely on a large number of learned parameters, tightly couple feature extraction with…

Artificial Intelligence · Computer Science 2026-05-12 Adam Gould , Francesca Toni

In this work we set out to find a method to classify protein structures using a Deep Learning methodology. Our Artificial Intelligence has been trained to recognize complex biomolecule structures extrapolated from the Protein Data Bank…

Machine Learning · Computer Science 2021-11-04 Damiano Perri , Marco Simonetti , Andrea Lombardi , Noelia Faginas-Lago , Osvaldo Gervasi

Given the growing complexity of healthcare data over the last several years, using machine learning techniques like Deep Neural Network (DNN) models has gained increased appeal. In order to extract hidden patterns and other valuable…

Machine Learning · Computer Science 2023-10-03 Hasan Hejbari Zargar , Saha Hejbari Zargar , Raziye Mehri

This paper presents a robust deep learning framework developed to detect respiratory diseases from recordings of respiratory sounds. The complete detection process firstly involves front end feature extraction where recordings are…

Sound · Computer Science 2020-02-11 Lam Pham , Ian McLoughlin , Huy Phan , Minh Tran , Truc Nguyen , Ramaswamy Palaniappan

Deep learning models extract, before a final classification layer, features or patterns which are key for their unprecedented advantageous performance. However, the process of complex nonlinear feature extraction is not well understood, a…

Computer Vision and Pattern Recognition · Computer Science 2020-06-18 Roozbeh Yousefzadeh , Furong Huang

Deep learning has demonstrated state-of-the-art performance for a variety of challenging computer vision tasks. On one hand, this has enabled deep visual models to pave the way for a plethora of critical applications like disease…

Machine Learning · Computer Science 2020-06-29 Mohammad A. A. K. Jalwana , Naveed Akhtar , Mohammed Bennamoun , Ajmal Mian
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