scholarly journals Porter 5: state-of-the-art ab initio prediction of protein secondary structure in 3 and 8 classes

2018 ◽  
Author(s):  
Mirko Torrisi ◽  
Manaz Kaleel ◽  
Gianluca Pollastri

AbstractMotivationAlthough Secondary Structure Predictors have been developed for more than 60 years, current ab initio methods have still some way to go to reach their theoretical limits. Moreover, the continuous effort towards harnessing ever increasing data sets and more sophisticated, deeper Machine Learning techniques, has not come to an end.ResultsHere we present Porter 5, the last release of one of the best performing ab initio secondary structure predictor. Version 5 achieves 84% accuracy (84% SOV) when tested on 3 classes, and 73% accuracy (82% SOV) on 8 classes, on a large independent set, significantly outperforming all the most recent ab initio predictors we have tested.AvailabilityThe web and standalone versions of Porter5 are available at http://distilldeep.ucd.ie/[email protected] informationSupplementary data are available at Bioinformatics online.

2020 ◽  
Author(s):  
Akash Bahai ◽  
Ehsaneddin Asgari ◽  
Mohammad R.K. Mofrad ◽  
Andreas Kloetgen ◽  
Alice C. McHardy

AbstractMotivationB-cell epitopes (BCEs) play a pivotal role in the development of peptide vaccines, immunodiagnostic reagents, and antibody production, and thus generally in infectious disease prevention and diagnosis. Experimental methods used to determine BCEs are costly and time-consuming. It thus becomes essential to develop computational methods for the rapid identification of BCEs. Though several computational methods have been developed for this task, cross-testing of classifiers trained and tested on different datasets revealed their limitations, with accuracies of 51 to 53%.ResultsWe describe a new method called EpitopeVec, which utilizes residue properties, modified antigenicity scales, and a Protvec representation of peptides for linear BCE prediction with machine learning techniques. Evaluating on several large and small data sets, as well as cross-testing demonstrated an improvement of the state-of-the-art performances in terms of accuracy and AUC. Predictive performance depended on the type of antigen (viral, bacterial, eukaryote, etc.). In view of that, we also trained our method on a large viral dataset to create a linear viral BCE predictor.AvailablityThe software is available at https://github.com/hzi-bifo/epitope-prediction under the GPL3.0 [email protected] informationSupplementary data are available at Bioinformatics online.


Energies ◽  
2021 ◽  
Vol 14 (16) ◽  
pp. 4776
Author(s):  
Seyed Mahdi Miraftabzadeh ◽  
Michela Longo ◽  
Federica Foiadelli ◽  
Marco Pasetti ◽  
Raul Igual

The recent advances in computing technologies and the increasing availability of large amounts of data in smart grids and smart cities are generating new research opportunities in the application of Machine Learning (ML) for improving the observability and efficiency of modern power grids. However, as the number and diversity of ML techniques increase, questions arise about their performance and applicability, and on the most suitable ML method depending on the specific application. Trying to answer these questions, this manuscript presents a systematic review of the state-of-the-art studies implementing ML techniques in the context of power systems, with a specific focus on the analysis of power flows, power quality, photovoltaic systems, intelligent transportation, and load forecasting. The survey investigates, for each of the selected topics, the most recent and promising ML techniques proposed by the literature, by highlighting their main characteristics and relevant results. The review revealed that, when compared to traditional approaches, ML algorithms can handle massive quantities of data with high dimensionality, by allowing the identification of hidden characteristics of (even) complex systems. In particular, even though very different techniques can be used for each application, hybrid models generally show better performances when compared to single ML-based models.


Author(s):  
Gediminas Adomavicius ◽  
Yaqiong Wang

Numerical predictive modeling is widely used in different application domains. Although many modeling techniques have been proposed, and a number of different aggregate accuracy metrics exist for evaluating the overall performance of predictive models, other important aspects, such as the reliability (or confidence and uncertainty) of individual predictions, have been underexplored. We propose to use estimated absolute prediction error as the indicator of individual prediction reliability, which has the benefits of being intuitive and providing highly interpretable information to decision makers, as well as allowing for more precise evaluation of reliability estimation quality. As importantly, the proposed reliability indicator allows the reframing of reliability estimation itself as a canonical numeric prediction problem, which makes the proposed approach general-purpose (i.e., it can work in conjunction with any outcome prediction model), alleviates the need for distributional assumptions, and enables the use of advanced, state-of-the-art machine learning techniques to learn individual prediction reliability patterns directly from data. Extensive experimental results on multiple real-world data sets show that the proposed machine learning-based approach can significantly improve individual prediction reliability estimation as compared with a number of baselines from prior work, especially in more complex predictive scenarios.


The Intrusion is a major threat to unauthorized data or legal network using the legitimate user identity or any of the back doors and vulnerabilities in the network. IDS mechanisms are developed to detect the intrusions at various levels. The objective of the research work is to improve the Intrusion Detection System performance by applying machine learning techniques based on decision trees for detection and classification of attacks. The methodology adapted will process the datasets in three stages. The experimentation is conducted on KDDCUP99 data sets based on number of features. The Bayesian three modes are analyzed for different sized data sets based upon total number of attacks. The time consumed by the classifier to build the model is analyzed and the accuracy is done.


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