Refereed journal article or data article (A1)
Neural Network and Random Forest Models in Protein Function Prediction
List of Authors: Hakala Kai, Kaewphan Suwisa, Björne Jari, Mehryary Farrokh, Moen Hans, Tolvanen Martti, Salakoski Tapio, Ginter Filip
Publisher: Institute of Electrical and Electronics Engineers Inc.
Publication year: 2022
Journal: IEEE/ACM Transactions on Computational Biology and Bioinformatics
Journal name in source: IEEE/ACM Transactions on Computational Biology and Bioinformatics
Volume number: 19
Issue number: 3
Start page: 1772
End page: 1781
eISSN: 1557-9964
DOI: http://dx.doi.org/10.1109/TCBB.2020.3044230
URL: https://doi.org/10.1109/TCBB.2020.3044230
Self-archived copy’s web address: https://research.utu.fi/converis/portal/detail/Publication/51384893
Over the past decade, the demand for automated protein function prediction has increased due to the volume of newly sequenced proteins. In this paper, we address the function prediction task by developing an ensemble system automatically assigning Gene Ontology (GO) terms to the given input protein sequence. We develop an ensemble system which combines the GO predictions made by random forest (RF) and neural network (NN) classifiers. Both RF and NN models rely on features derived from BLAST sequence alignments, taxonomy and protein signature analysis tools. In addition, we report on experiments with a NN model that directly analyzes the amino acid sequence as its sole input, using a convolutional layer. The Swiss-Prot database is used as the training and evaluation data. In the CAFA3 evaluation, which relies on experimental verification of the functional predictions, our submitted ensemble model demonstrates competitive performance ranking among top-10 best-performing systems out of over 100 submitted systems. In this paper, we evaluate and further improve the CAFA3-submitted system. Our machine learning models together with the data pre-processing and feature generation tools are publicly available as an open source software at https://github.com/TurkuNLP/CAFA3.
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