Developing ANN-Kriging hybrid model based on process parameters for prediction of mean residence time distribution in twin-screw updates wet granulation

被引:78
作者
Ismail, Hamza Y. [1 ,2 ]
Singh, Mehakpreet [2 ]
Darwish, Shaza [2 ]
Kuhs, Manuel [2 ]
Shirazian, Saeed [2 ]
Croker, Denise M. [2 ]
Khraisheh, Majeda [3 ]
Albadarin, Ahmad B. [1 ,2 ]
Walker, Gavin M. [1 ,2 ]
机构
[1] Univ Limerick, Pharmaceut Mfg Technol Ctr, Bernal Inst, Limerick, Ireland
[2] Univ Limerick, Bernal Inst, Dept Chem Sci, Limerick, Ireland
[3] Qatar Univ, Dept Chem Engn, Coll Engn, Doha, Qatar
基金
爱尔兰科学基金会;
关键词
Artificial neural network; Kriging; Twin-screw granulator; Continuous pharmaceutical manufacturing; Residence time; Model predictive control; BATCH;
D O I
10.1016/j.powtec.2018.11.060
中图分类号
TQ [化学工业];
学科分类号
0817 ;
摘要
Artificial neural network (ANN) modelling is applied to predict the mean residence time of pharmaceutical formulation in a twin-screw granulator. Process parameters including feed flow rate, screw speed, and liquid to solid ratio are correlated with the obtained values of mean residence time to build a predictive tool. In order to improve the ANN predictive capability, a kriging interpolation approach is utilised and both ANN models (before and after kriging) are compared. Experimental data is obtained for wet granulation of microcrystalline cellulose using a bench-scale 12 mm twin-screw granulator. In addition, the effect of screw configurations on mean residence time is investigated by the developed ANN. The ANN model is made of two hidden layers with 2 linear nodes in each layer, and the linear system of equations is derived for the improved ANN model. The results revealed that the developed model was capable of predicting the mean residence time in the granulator more accurately after applying kriging interpolation, with an R-2 value of about 0.92 for both training and validation. ANN model after kriging shows a dramatic improvement of R-2 by 4% and 22% in training and validating phases, respectively. Also, the RMSE was improved by 40% and 61.5% in training and validating phases, respectively. Furthermore, this improvement was reflected in the contour profiles of the ANN models before and after kriging interpolation, where the model that uses the interpolated data points shows a smoother contour profiles and wider prediction areas. Screw configuration has the most significant effect on the residence time of granules inside the granulator where adding more kneading zones results in a substantial increase in the mean residence time compared to other process parameters. (C) 2018 Elsevier B.V. All rights reserved.
引用
收藏
页码:568 / 577
页数:10
相关论文
共 23 条
  • [1] Multi-scale modeling of granulation processes: Bi-directional coupling of PBM with DEM via collision frequencies
    Barrasso, Dana
    Ramachandran, Rohit
    [J]. CHEMICAL ENGINEERING RESEARCH & DESIGN, 2015, 93 : 304 - 317
  • [2] Multi-dimensional population balance model development and validation for a twin screw granulation process
    Barrasso, Dana
    El Hagrasy, Arwa
    Litster, James D.
    Ramachandran, Rohit
    [J]. POWDER TECHNOLOGY, 2015, 270 : 612 - 621
  • [3] Multi-component population balance modeling of continuous granulation processes: A parametric study and comparison with experimental trends
    Barrasso, Dana
    Walia, Samjit
    Ramachandran, Rohit
    [J]. POWDER TECHNOLOGY, 2013, 241 : 85 - 97
  • [4] Dynamic Data-Driven Modeling of Pharmaceutical Processes
    Boukouvala, F.
    Muzzio, F. J.
    Ierapetritou, Marianthi G.
    [J]. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2011, 50 (11) : 6743 - 6754
  • [5] Design Space of Pharmaceutical Processes Using Data-Driven-Based Methods
    Boukouvala, Fani
    Muzzio, Fernando J.
    Ierapetritou, Marianthi G.
    [J]. JOURNAL OF PHARMACEUTICAL INNOVATION, 2010, 5 (03) : 119 - 137
  • [6] Computational intelligence modeling of granule size distribution for oscillating milling
    Kazemi, Pezhman
    Khalid, Mohammad Hassan
    Szlek, Jakub
    Mirtic, Andreja
    Reynolds, Gavin K.
    Jachowicz, Renata
    Mendyk, Aleksander
    [J]. POWDER TECHNOLOGY, 2016, 301 : 1252 - 1258
  • [7] Digital image processing for measurement of residence time distribution in a laboratory extruder
    Kumar, A
    Ganjyal, GM
    Jones, DD
    Hanna, MA
    [J]. JOURNAL OF FOOD ENGINEERING, 2006, 75 (02) : 237 - 244
  • [8] Linking granulation performance with residence time and granulation liquid distributions in twin-screw granulation: An experimental investigation
    Kumar, Ashish
    Alakarjula, Maija
    Vanhoorne, Valerie
    Toiviainen, Maunu
    De Leersnyder, Fien
    Vercruysse, Jurgen
    Juuti, Mikko
    Ketolainen, Jarkko
    Vervaet, Chris
    Remon, Jean Paul
    Gernaey, Krist V.
    De Beer, Thomas
    Nopens, Ingmar
    [J]. EUROPEAN JOURNAL OF PHARMACEUTICAL SCIENCES, 2016, 90 : 25 - 37
  • [9] Kumar A, 2015, COMPUT-AIDED CHEM EN, V37, P2165
  • [10] Model-based analysis of high shear wet granulation from batch to continuous processes in pharmaceutical production - A critical review
    Kumar, Ashish
    Gernaey, Krist V.
    De Beer, Thomas
    Nopens, Ingmar
    [J]. EUROPEAN JOURNAL OF PHARMACEUTICS AND BIOPHARMACEUTICS, 2013, 85 (03) : 814 - 832