Hybrid transformer-CNN model for accurate prediction of peptide hemolytic potential

被引:0
作者
Almotairi, Sultan [1 ,2 ]
Badr, Elsayed [3 ,4 ]
Abdelbaky, Ibrahim [5 ]
Elhakeem, Mohamed [5 ]
Abdul Salam, Mustafa [5 ,6 ]
机构
[1] Majmaah Univ, Fac Coll Comp & Informat Sci, Dept Comp Sci, Majmaah 11952, Saudi Arabia
[2] Islamic Univ Madinah, Fac Comp & Informat Syst, Dept Comp Sci, Medinah 42351, Saudi Arabia
[3] Benha Univ, Fac Comp & Artificial Intelligence, Sci Comp Dept, Banha, Egypt
[4] Egyptian Sch Data Sci ESDS, Banha, Egypt
[5] Benha Univ, Fac Comp & Artificial Intelligence, Artificial Intelligence Dept, Banha, Egypt
[6] Prince Sattam Bin Abdulaziz Univ, Coll Arts & Sci Wadi Addawasir, Dept Comp Sci, Al Kharj 16273, Saudi Arabia
来源
SCIENTIFIC REPORTS | 2024年 / 14卷 / 01期
关键词
Peptides; Hemolysis; Deep learning; Convolutional neural networks (CNNs); Transformers; Drug design; Hemolytic prediction; ANTIMICROBIAL PEPTIDES;
D O I
10.1038/s41598-024-63446-5
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 ; 0710 ; 09 ;
摘要
Hemolysis is a crucial factor in various biomedical and pharmaceutical contexts, driving our interest in developing advanced computational techniques for precise prediction. Our proposed approach takes advantage of the unique capabilities of convolutional neural networks (CNNs) and transformers to detect complex patterns inherent in the data. The integration of CNN and transformers' attention mechanisms allows for the extraction of relevant information, leading to accurate predictions of hemolytic potential. The proposed method was trained on three distinct data sets of peptide sequences known as recurrent neural network-hemolytic (RNN-Hem), Hlppredfuse, and Combined. Our computational results demonstrated the superior efficacy of our models compared to existing methods. The proposed approach demonstrated impressive Matthews correlation coefficients of 0.5962, 0.9111, and 0.7788 respectively, indicating its effectiveness in predicting hemolytic activity. With its potential to guide experimental efforts in peptide design and drug development, this method holds great promise for practical applications. Integrating CNNs and transformers proves to be a powerful tool in the fields of bioinformatics and therapeutic research, highlighting their potential to drive advancement in this area.
引用
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页数:9
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