An optimized deep-forest algorithm using a modified differential evolution optimization algorithm: A case of host-pathogen protein-protein interaction prediction
Jerry Emmanuel , Itunuoluwa Isewon , Jelili Oyelade
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引用次数: 0
Abstract
Deep Forest employs forest structures and leverages deep architecture to learn feature vector information adaptively. However, deep forest-based models have limitations such as manual hyperparameter optimization and time and memory usage inefficiencies. Bayesian optimization is a widely used model-based hyperparameter optimization method. Evolutionary algorithms such as Differential Evolution (DE) have recently been introduced to improve Bayesian optimization’s acquisition function. Despite its effectiveness, DE has a significant drawback as it relies on randomly selecting indices from the population of target vectors to construct donor vectors in search of optimal solutions. This randomness is ineffective, as suboptimal or redundant indices may be selected. Therefore, in this research we developed a modified differential evolution (DE) acquisition function for improved host-pathogen protein-protein interaction prediction. The modified DE introduces a weighted and adaptive donor vector technique that selects the best-fitted donor vectors as opposed to the random approach. This modified optimization approach was implemented in a deep forest model for automatic hyperparameter optimization. The performance of the optimized deep forest model was evaluated on human-Plasmodium falciparum protein sequence datasets using 10-fold cross-validation. The results were compared with standard optimization methods such as traditional Bayesian optimization, genetic algorithms, evolutionary strategies, and other machine learning models. The optimized model achieved an accuracy of 89.3 %, outperforming other models across all metrics, including a sensitivity of 85.4 % and a precision of 91.6 %. Additionally, the optimized model predicted seven novel host-pathogen interactions. Finally, the model was implemented as a web application which is accessible at http://dfh3pi.covenantuniversity.edu.ng.
期刊介绍:
Computational and Structural Biotechnology Journal (CSBJ) is an online gold open access journal publishing research articles and reviews after full peer review. All articles are published, without barriers to access, immediately upon acceptance. The journal places a strong emphasis on functional and mechanistic understanding of how molecular components in a biological process work together through the application of computational methods. Structural data may provide such insights, but they are not a pre-requisite for publication in the journal. Specific areas of interest include, but are not limited to:
Structure and function of proteins, nucleic acids and other macromolecules
Structure and function of multi-component complexes
Protein folding, processing and degradation
Enzymology
Computational and structural studies of plant systems
Microbial Informatics
Genomics
Proteomics
Metabolomics
Algorithms and Hypothesis in Bioinformatics
Mathematical and Theoretical Biology
Computational Chemistry and Drug Discovery
Microscopy and Molecular Imaging
Nanotechnology
Systems and Synthetic Biology