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1.
Comput Biol Med ; 173: 108385, 2024 May.
Article in English | MEDLINE | ID: mdl-38547659

ABSTRACT

Alkaliphilic proteins have great potential as biocatalysts in biotechnology, especially for enzyme engineering. Extensive research has focused on exploring the enzymatic potential of alkaliphiles and characterizing alkaliphilic proteins. However, the current method employed for identifying these proteins that requires web lab experiment is time-consuming, labor-intensive, and expensive. Therefore, the development of a computational method for alkaliphilic protein identification would be invaluable for protein engineering and design. In this study, we present a novel approach that uses embeddings from a protein language model called ESM-2(3B) in a deep learning framework to classify alkaliphilic and non-alkaliphilic proteins. To our knowledge, this is the first attempt to employ embeddings from a pre-trained protein language model to classify alkaliphilic protein. A reliable dataset comprising 1,002 alkaliphilic and 1,866 non-alkaliphilic proteins was constructed for training and testing the proposed model. The proposed model, dubbed ALPACA, achieves performance scores of 0.88, 0.84, and 0.75 for accuracy, f1-score, and Matthew correlation coefficient respectively on independent dataset. ALPACA is likely to serve as a valuable resource for exploring protein alkalinity and its role in protein design and engineering.


Subject(s)
Camelids, New World , Animals , Proteins , Language
2.
Comput Biol Med ; 163: 107241, 2023 09.
Article in English | MEDLINE | ID: mdl-37437362

ABSTRACT

Predicting DNA-binding proteins (DBPs) based solely on primary sequences is one of the most challenging problems in genome annotation. DBPs play a crucial role in various biological processes, including DNA replication, transcription, repair, and splicing. Some DBPs are essential in pharmaceutical research on various human cancers and autoimmune diseases. Existing experimental methods for identifying DBPs are time-consuming and costly. Therefore, developing a rapid and accurate computational technique is necessary to address the issue. This study introduces BiCaps-DBP, a deep learning-based method that improves DBP prediction performance by combining bidirectional long short-term memory with a 1D-capsule network. This study uses three training and independent datasets to evaluate the proposed model's generalizability and robustness. Based on three independent datasets, BiCaps-DBP achieved 1.05%, 5.79% and 0.40% higher accuracies than an existing predictor for PDB2272, PDB186 and PDB20000, respectively. These outcomes indicate that the proposed method is a promising DBP predictor.


Subject(s)
DNA-Binding Proteins , Genome , Humans , DNA-Binding Proteins/genetics , DNA-Binding Proteins/metabolism , Amino Acid Sequence
3.
PLoS One ; 18(5): e0285981, 2023.
Article in English | MEDLINE | ID: mdl-37228159

ABSTRACT

Early detection of breast cancer can be achieved through mutation detection in DNA sequences, which can be acquired through patient blood samples. Mutation detection can be performed using alignment and machine learning techniques. However, alignment techniques require reference sequences, and machine learning techniques still cannot predict index mutation and require supporting tools. Therefore, in this research, a Temporal Convolutional Network (TCN) model was proposed to detect the type and index mutation faster and without reference sequences and supporting tools. The architecture of the proposed TCN model is specifically designed for sequential labeling tasks on DNA sequence data. This allows for the detection of the mutation type of each nucleotide in the sequence, and if the nucleotide has a mutation, the index mutation can be obtained. The proposed model also uses 2-mers and 3-mers mapping techniques to improve detection performance. Based on the tests that have been carried out, the proposed TCN model can achieve the highest F1-score of 0.9443 for COSMIC dataset and 0.9629 for RSCM dataset, Additionally, the proposed TCN model can detect index mutation six times faster than BiLSTM model. Furthermore, the proposed model can detect type and index mutations based on the patient's DNA sequence, without the need for reference sequences or other additional tools.


Subject(s)
Breast Neoplasms , Humans , Female , Breast Neoplasms/diagnosis , Breast Neoplasms/genetics , DNA , Machine Learning , Mutation , Nucleotides
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