Scalable and Efficient Protein Secondary Structure Prediction Using Autoencoder-Reduced ProtBERT Embeddings

This study proposes a deep learning framework for Protein Secondary Structure Prediction (PSSP) that prioritizes computational efficiency while preserving classification accuracy. Leveraging ProtBERT-derived embeddings, we apply autoencoder-based dimensionality reduction to compress high-dimensional sequence representations. These are segmented into fixed-length subsequences, enabling efficient input formatting for a Bi-LSTM-based classifier. Our experiments, conducted on a curated PISCES-based dataset, reveal that reducing input dimensions from 1024 to 256 preserves over 99% of predictive performance (Q3 F1 score: 0.8049 → 0.8023) while reducing GPU memory usage by 67% and training time by 43%. Moreover, subsequence lengths of 50 residues provide an optimal trade-off between contextual learning and training stability. Compared to baseline configurations, the proposed framework reduces training overhead substantially without compromising structural accuracy in both the Q3 and Q8 classification schemes. These findings offer a practical pathway for scalable protein structure prediction, particularly in resource-constrained environments.

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Publication Details

Journal
Applied Sciences
Published
2025-06-24
DOI
https://doi.org/10.3390/app15137112
Citations
1
Primary Topic
Machine Learning in Bioinformatics
Type
article
Field-Weighted Citation Impact
0.81

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article

Scalable and Efficient Protein Secondary Structure Prediction Using Autoencoder-Reduced ProtBERT Embeddings

Hakan Gündüz, İrfan Kösesoy, Ömer Faruk Yılmaz, Yahya Najib Hamood Al-Shameri
1 citations
Applied Sciences
Machine Learning in Bioinformatics
0.81
article

Scalable and Efficient Protein Secondary Structure Prediction Using Autoencoder-Reduced ProtBERT Embeddings

Hakan Gündüz, İrfan Kösesoy, Ömer Faruk Yılmaz, Yahya Najib Hamood Al-Shameri
article en
1 citations

Abstract

This study proposes a deep learning framework for Protein Secondary Structure Prediction (PSSP) that prioritizes computational efficiency while preserving classification accuracy. Leveraging ProtBERT-derived embeddings, we apply autoencoder-based dimensionality reduction to compress high-dimensional sequence representations. These are segmented into fixed-length subsequences, enabling efficient input formatting for a Bi-LSTM-based classifier. Our experiments, conducted on a curated PISCES-based dataset, reveal that reducing input dimensions from 1024 to 256 preserves over 99% of predictive performance (Q3 F1 score: 0.8049 → 0.8023) while reducing GPU memory usage by 67% and training time by 43%. Moreover, subsequence lengths of 50 residues provide an optimal trade-off between contextual learning and training stability. Compared to baseline configurations, the proposed framework reduces training overhead substantially without compromising structural accuracy in both the Q3 and Q8 classification schemes. These findings offer a practical pathway for scalable protein structure prediction, particularly in resource-constrained environments.

Applied SciencesVol. 15(13)
Karadeniz Technical University (TR), Kocaeli Üniversitesi (TR), Software (Spain) (ES)
Kocaeli Üniversitesi
Openalex Percentile: Top 27%
Machine Learning in Bioinformatics
0.81
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