Residential College | false |
Status | 已發表Published |
A deep learning method for predicting the minimum inhibitory concentration of antimicrobial peptides against Escherichia coli using Multi-Branch-CNN and Attention | |
Yan, Jielu1; Zhang, Bob1; Zhou, Mingliang2; Campbell-Valois, François Xavier3,4,5; Siu, Shirley W.I.6 | |
Source Publication | mSystems |
ISSN | 2379-5077 |
2023-07-11 | |
Abstract | Antimicrobial peptides (AMPs) are a promising alternative to antibiotics to combat drug resistance in pathogenic bacteria. However, the development of AMPs with high potency and specificity remains a challenge, and new tools to evaluate antimicrobial activity are needed to accelerate the discovery process. Therefore, we proposed MBC-Attention, a combination of a multi-branch convolution neural network architecture and attention mechanisms to predict the experimental minimum inhibitory concentration of peptides against Escherichia coli. The optimal MBC-Attention model achieved an average Pearson correlation coefficient (PCC) of 0.775 and a root mean squared error (RMSE) of 0.533 (log μM) in three independent tests of randomly drawn sequences from the data set. This results in a 5–12% improvement in PCC and a 6– 13% improvement in RMSE compared to 17 traditional machine learning models and 2 optimally tuned models using random forest and support vector machine. Ablation studies confirmed that the two proposed attention mechanisms, global attention and local attention, contributed largely to performance improvement. |
Keyword | Antimicrobial Peptides Deep Learning Drug Discovery Minimum Inhibitory Concentrations Regression |
Language | 英語English |
DOI | 10.1128/msystems.00345-23 |
URL | View the original |
Volume | 8 |
Issue | 4 |
WOS ID | WOS:001023603300001 |
WOS Subject | Microbiology |
WOS Research Area | Microbiology |
Indexed By | SCIE |
Scopus ID | 2-s2.0-85171147489 |
Fulltext Access | |
Citation statistics | |
Document Type | Review article |
Collection | Faculty of Science and Technology DEPARTMENT OF COMPUTER AND INFORMATION SCIENCE |
Corresponding Author | Zhang, Bob; Siu, Shirley W.I. |
Affiliation | 1.PAMI Research Group, Department of Computer and Information Science, University of Macau, Taipa, Macau, Macao 2.School of Computer Science, Chongqing University, Shapingba, Chongqing, China 3.Host-Microbe Interactions Laboratory, Center for Chemical and Synthetic Biology, Department of Chemistry and Biomolecular Sciences, University of Ottawa, Ottawa, Canada 4.Centre for Infection, Immunity, and Inflammation, University of Ottawa, Ottawa, Canada 5.Department of Biochemistry, Microbiology and Immunology, University of Ottawa, Ottawa, Canada 6.Institute of Science and Environment, University of Saint Joseph, Macau, Macao |
First Author Affilication | University of Macau |
Corresponding Author Affilication | University of Macau |
Recommended Citation GB/T 7714 | Yan, Jielu,Zhang, Bob,Zhou, Mingliang,et al. A deep learning method for predicting the minimum inhibitory concentration of antimicrobial peptides against Escherichia coli using Multi-Branch-CNN and Attention[J]. mSystems, 2023, 8(4). |
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