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Machine Learning (ML) applications on healthcare can have a great impact on people's lives helping deliver better and timely treatment to those in need. At the same time, medical data is usually big and sparse requiring important…

Machine Learning · Computer Science 2018-12-27 Dianbo Liu , Nestor Sepulveda , Ming Zheng

INTRODUCTION: The pharmacological treatment of Major Depressive Disorder (MDD) relies on a trial-and-error approach. We introduce an artificial intelligence (AI) model aiming to personalize treatment and improve outcomes, which was deployed…

Absorption, distribution, metabolism, and excretion (ADME) studies are critical for drug discovery. Conventionally, these tasks, together with other chemical property predictions, rely on domain-specific feature descriptors, or…

Machine Learning · Computer Science 2018-03-22 Ke Liu , Xiangyan Sun , Lei Jia , Jun Ma , Haoming Xing , Junqiu Wu , Hua Gao , Yax Sun , Florian Boulnois , Jie Fan

Dysphagia affects 590 million people worldwide and increases risk for malnutrition. Pureed food may reduce choking, however preparation differences impact nutrient density making quality assurance necessary. This paper is the first study to…

Computer Vision and Pattern Recognition · Computer Science 2017-11-06 Kaylen J. Pfisterer , Robert Amelard , Audrey G. Chung , Alexander Wong

Droughts, with their increasing frequency of occurrence, continue to negatively affect livelihoods and elements at risk. For example, the 2011 in drought in east Africa has caused massive losses document to have cost the Kenyan economy over…

Applications · Statistics 2019-01-16 Chrisgone Adede , Robert Oboko , Peter Wagacha , Clement Atzberger

Predicting the health of components in complex dynamic systems such as an automobile poses numerous challenges. The primary aim of such predictive systems is to use the high-dimensional data acquired from different sensors and predict the…

Machine Learning · Computer Science 2018-04-17 Arvind Kumar Shekar , Cláudio Rebelo de Sá , Hugo Ferreira , Carlos Soares

3\b{eta}-O-phthalic ester of betulinic acid is of great importance in anticancer studies. However, the optimization of its reaction conditions requires a large number of experimental works. To simplify the number of times of optimization in…

Machine Learning · Computer Science 2015-11-13 Run Wang , Qiaoli Mo , Qian Zhang , Fudi Chen , Dazuo Yang

Obtaining human-readable symbolic formulas via genetic programming-based symbolic distillation of a deep neural network trained on the target dataset presents a promising yet underexplored path towards explainable artificial intelligence…

Machine Learning · Computer Science 2026-04-15 Soumyadeep Dhar , Kei Sen Fong , Mehul Motani

In recent years, the integration of Machine Learning (ML) models with Operation Research (OR) tools has gained popularity across diverse applications, including cancer treatment, algorithmic configuration, and chemical process optimization.…

Machine Learning · Computer Science 2023-07-17 Matteo Cacciola , Antonio Frangioni , Andrea Lodi

Adder Neural Networks (ANNs) which only contain additions bring us a new way of developing deep neural networks with low energy consumption. Unfortunately, there is an accuracy drop when replacing all convolution filters by adder filters.…

Computer Vision and Pattern Recognition · Computer Science 2020-10-16 Yixing Xu , Chang Xu , Xinghao Chen , Wei Zhang , Chunjing Xu , Yunhe Wang

The trade-off between predictive accuracy and data availability makes it difficult to predict protein--protein binding affinity accurately. The lack of experimentally resolved protein structures limits the performance of structure-based…

Machine Learning · Computer Science 2026-01-08 Wajid Arshad Abbasi , Syed Ali Abbas , Maryum Bibi , Saiqa Andleeb , Muhammad Naveed Akhtar

Sentiment analysis has become increasingly important in healthcare, especially in the biomedical and pharmaceutical fields. The data generated by the general public on the effectiveness, side effects, and adverse drug reactions are…

Computation and Language · Computer Science 2024-04-23 Abhiram B. Nair , Abhinand K. , Anamika U. , Denil Tom Jaison , Ajitha V. , V. S. Anoop

Adversarial examples, designed to trick Artificial Neural Networks (ANNs) into producing wrong outputs, highlight vulnerabilities in these models. Exploring these weaknesses is crucial for developing defenses, and so, we propose a method to…

Machine Learning · Computer Science 2024-06-21 Inês Valentim , Nuno Antunes , Nuno Lourenço

Design of new drugs is a challenging process: a candidate molecule should satisfy multiple conditions to act properly and make the least side-effect -- perfect candidates selectively attach to and influence only targets, leaving off-targets…

Biomolecules · Quantitative Biology 2024-05-07 Andrij Rovenchak , Maksym Druchok

Machine learning and deep learning have gained popularity and achieved immense success in Drug discovery in recent decades. Historically, machine learning and deep learning models were trained on either structural data or chemical…

Machine Learning · Statistics 2019-09-18 Huy Ngoc Pham , Trung Hoang Le

In this paper, we introduce a novel artificial neural network (ANN) based scheme to estimate the thickness of thin films deposited on a given substrate. Here we consider the visible interference pattern between a plane wave and a diverging…

Machine Learning · Computer Science 2022-10-21 Archana Bora

De novo molecule generation often results in chemically unfeasible molecules. A natural idea to mitigate this problem is to bias the search process towards more easily synthesizable molecules using a proxy for synthetic accessibility.…

In recent years, several successful applications of the Artificial Neural Networks (ANNs) have emerged in nuclear physics and high-energy physics, as well as in biology, chemistry, meteorology, and other fields of science. A major goal of…

With the increasing use of nonlinear devices in both generation and consumption of power, it is essential that we develop accurate and quick control for active filters to suppress harmonics. Time delays between input and output are…

Systems and Control · Electrical Eng. & Systems 2024-10-04 Dixant Bikal Sapkota , Puskar Neupane , Kajal Pokharel , Shahabuddin Khan

Emerged as a biology-inspired method, Spiking Neural Networks (SNNs) mimic the spiking nature of brain neurons and have received lots of research attention. SNNs deal with binary spikes as their activation and therefore derive extreme…

Computer Vision and Pattern Recognition · Computer Science 2023-05-04 Yufei Guo , Weihang Peng , Yuanpei Chen , Liwen Zhang , Xiaode Liu , Xuhui Huang , Zhe Ma