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Implementation of near-infrared spectroscopy and convolutional neural networks for predicting particle size distribution in fluidized bed granulation. | LitMetric

Implementation of near-infrared spectroscopy and convolutional neural networks for predicting particle size distribution in fluidized bed granulation.

Int J Pharm

NMPA Key Laboratory for Technology Research and Evaluation of Drug Products, School of Pharmaceutical Sciences, Cheeloo College of Medicine, Shandong University, Jinan 250012, Shandong, China; National Glycoengineering Research Center, Shandong University, Jinan 250012, Shandong, China; Key Laboratory of Chemical Biology (Ministry of Education), Shandong University, Jinan 250012, China. Electronic address:

Published: April 2024

AI Article Synopsis

  • Monitoring particle size distribution (PSD) is essential for maintaining product quality in fluidized bed granulation, and this paper introduces a new analytical method using a Convolutional Block Attention Module-Convolutional Neural Network (CBAM-CNN) for improved accuracy.
  • The CBAM-CNN framework enhances feature extraction by combining attention mechanisms with deep learning, while also leveraging the C-Mixup algorithm to expand the training dataset and the Bayesian optimization for better hyperparameter tuning.
  • When tested against traditional methods like Partial Least Squares (PLS) and Support Vector Machines (SVM), the CBAM-CNN model outperformed them in predicting PSD values without needing extensive spectral preprocessing.

Article Abstract

Monitoring the particle size distribution (PSD) is crucial for controlling product quality during fluidized bed granulation. This paper proposed a rapid analytical method that quantifies the D10, D50, and D90 values using a Convolutional Block Attention Module-Convolutional Neural Network (CBAM-CNN) framework tailored for deep learning with near-infrared (NIR) spectroscopy. This innovative framework, which fuses CBAM with CNN, excels at extracting intricate features while prioritizing crucial ones, thereby facilitating the creation of a robust multi-output regression model. To expand the training dataset, we incorporated the C-Mixup algorithm, ensuring that the deep learning model was trained comprehensively. Additionally, the Bayesian optimization algorithm was introduced to optimize the hyperparameters, improving the prediction performance of the deep learning model. Compared with the commonly used Partial Least Squares (PLS), Support Vector Machine (SVM), and Artificial Neural Network (ANN) models, the CBAM-CNN model yielded higher prediction accuracy. Furthermore, the CBAM-CNN model avoided spectral preprocessing, preserved the spectral information to the maximum extent, and returned multiple predicted values at one time without degrading the prediction accuracy. Therefore, the CBAM-CNN model showed better prediction performance and modeling convenience for analyzing PSD values in fluidized bed granulation.

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Source
http://dx.doi.org/10.1016/j.ijpharm.2024.124001DOI Listing

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