Development of high-performance hybrid ANN-finite volume scheme (ANN-FVS) for simulation of pharmaceutical continuous granulation
•Continuous wet granulation of pharmaceutical formulations.•Compartmental modelling of twin screw granulation using population balance.•Development of hybrid ANN-finite volume scheme to solve the model.•Studying the effect of numerical method for solving compartmental population balance models. A hy...
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creator | Ismail, Hamza Y. Singh, Mehakpreet Shirazian, Saeed Albadarin, Ahmad B. Walker, Gavin M. |
description | •Continuous wet granulation of pharmaceutical formulations.•Compartmental modelling of twin screw granulation using population balance.•Development of hybrid ANN-finite volume scheme to solve the model.•Studying the effect of numerical method for solving compartmental population balance models.
A hybrid model was developed for simulation of continuous wet granulation of pharmaceutical formulations via twin-screw granulator. The model was based on population balance model (PBM) for prediction of particle size distribution, while artificial neural network (ANN) was used for estimation of mean residence time which is required for numerical solution of PBM. A new numerical scheme based on finite volume approach was developed for solution of one dimensional PBM to predict granule size distribution obtained in a twin-screw granulator. The model takes into account liquid and feed flow rates, and screw speed, while the granule size distribution is the model's main output. Aggregation and breakage were considered as the main mechanisms in the process, and the model was developed and solved for different zones of extruder, i.e. conveying and kneading ones. The model's predictions were validated through comparing with experimental data collected using a 12mm twin-screw extruder for granulation of microcrystalline cellulose. The results indicated that the model is facile, robust and valid, which can predict the performance of twin-screw granulator for pharmaceutical formulations. |
doi_str_mv | 10.1016/j.cherd.2020.09.002 |
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A hybrid model was developed for simulation of continuous wet granulation of pharmaceutical formulations via twin-screw granulator. The model was based on population balance model (PBM) for prediction of particle size distribution, while artificial neural network (ANN) was used for estimation of mean residence time which is required for numerical solution of PBM. A new numerical scheme based on finite volume approach was developed for solution of one dimensional PBM to predict granule size distribution obtained in a twin-screw granulator. The model takes into account liquid and feed flow rates, and screw speed, while the granule size distribution is the model's main output. Aggregation and breakage were considered as the main mechanisms in the process, and the model was developed and solved for different zones of extruder, i.e. conveying and kneading ones. The model's predictions were validated through comparing with experimental data collected using a 12mm twin-screw extruder for granulation of microcrystalline cellulose. The results indicated that the model is facile, robust and valid, which can predict the performance of twin-screw granulator for pharmaceutical formulations.</description><identifier>ISSN: 0263-8762</identifier><identifier>EISSN: 1744-3563</identifier><identifier>DOI: 10.1016/j.cherd.2020.09.002</identifier><language>eng</language><publisher>AMSTERDAM: Elsevier B.V</publisher><subject>Artificial neural networks ; Crystalline cellulose ; Engineering ; Engineering, Chemical ; Finite volume method ; Finite volume scheme ; Flow velocity ; Fluid dynamics ; Granular materials ; Granulation ; Granulators ; Mathematical models ; Neural networks ; Particle size ; Particle size distribution ; Pharmaceuticals ; Population balance model ; Population balance models ; Process modelling ; Robustness (mathematics) ; Science & Technology ; Simulation ; Technology ; Twin screw extruders ; Twin-screw granulation</subject><ispartof>Chemical engineering research & design, 2020-11, Vol.163, p.320-326</ispartof><rights>2020 Institution of Chemical Engineers</rights><rights>Copyright Elsevier Science Ltd. Nov 2020</rights><lds50>peer_reviewed</lds50><oa>free_for_read</oa><woscitedreferencessubscribed>true</woscitedreferencessubscribed><woscitedreferencescount>33</woscitedreferencescount><woscitedreferencesoriginalsourcerecordid>wos000582383400030</woscitedreferencesoriginalsourcerecordid><citedby>FETCH-LOGICAL-c442t-a9dba58692ee11594057bccb6d3d5ec6aa5a2b8078f7ad51652df6af049e064e3</citedby><cites>FETCH-LOGICAL-c442t-a9dba58692ee11594057bccb6d3d5ec6aa5a2b8078f7ad51652df6af049e064e3</cites><orcidid>0000-0002-6392-6068</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktohtml>$$Uhttps://dx.doi.org/10.1016/j.cherd.2020.09.002$$EHTML$$P50$$Gelsevier$$Hfree_for_read</linktohtml><link.rule.ids>315,782,786,3554,27933,27934,28257,46004</link.rule.ids></links><search><creatorcontrib>Ismail, Hamza Y.</creatorcontrib><creatorcontrib>Singh, Mehakpreet</creatorcontrib><creatorcontrib>Shirazian, Saeed</creatorcontrib><creatorcontrib>Albadarin, Ahmad B.</creatorcontrib><creatorcontrib>Walker, Gavin M.</creatorcontrib><title>Development of high-performance hybrid ANN-finite volume scheme (ANN-FVS) for simulation of pharmaceutical continuous granulation</title><title>Chemical engineering research & design</title><addtitle>CHEM ENG RES DES</addtitle><description>•Continuous wet granulation of pharmaceutical formulations.•Compartmental modelling of twin screw granulation using population balance.•Development of hybrid ANN-finite volume scheme to solve the model.•Studying the effect of numerical method for solving compartmental population balance models.
A hybrid model was developed for simulation of continuous wet granulation of pharmaceutical formulations via twin-screw granulator. The model was based on population balance model (PBM) for prediction of particle size distribution, while artificial neural network (ANN) was used for estimation of mean residence time which is required for numerical solution of PBM. A new numerical scheme based on finite volume approach was developed for solution of one dimensional PBM to predict granule size distribution obtained in a twin-screw granulator. The model takes into account liquid and feed flow rates, and screw speed, while the granule size distribution is the model's main output. Aggregation and breakage were considered as the main mechanisms in the process, and the model was developed and solved for different zones of extruder, i.e. conveying and kneading ones. The model's predictions were validated through comparing with experimental data collected using a 12mm twin-screw extruder for granulation of microcrystalline cellulose. The results indicated that the model is facile, robust and valid, which can predict the performance of twin-screw granulator for pharmaceutical formulations.</description><subject>Artificial neural networks</subject><subject>Crystalline cellulose</subject><subject>Engineering</subject><subject>Engineering, Chemical</subject><subject>Finite volume method</subject><subject>Finite volume scheme</subject><subject>Flow velocity</subject><subject>Fluid dynamics</subject><subject>Granular materials</subject><subject>Granulation</subject><subject>Granulators</subject><subject>Mathematical models</subject><subject>Neural networks</subject><subject>Particle size</subject><subject>Particle size distribution</subject><subject>Pharmaceuticals</subject><subject>Population balance model</subject><subject>Population balance models</subject><subject>Process modelling</subject><subject>Robustness (mathematics)</subject><subject>Science & Technology</subject><subject>Simulation</subject><subject>Technology</subject><subject>Twin screw extruders</subject><subject>Twin-screw granulation</subject><issn>0263-8762</issn><issn>1744-3563</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2020</creationdate><recordtype>article</recordtype><sourceid>AOWDO</sourceid><recordid>eNqNkD2P1DAQhiMEEsvBL6CxRANCCRMncZyC4rTHAdLpKPhoLceeXLxK7GA7i67kn-PcrigR1RTzPu-Mnix7WUJRQsneHQo1otcFBQoFdAUAfZTtyrau86ph1eNsB5RVOW8ZfZo9C-EAAGnLd9nvKzzi5JYZbSRuIKO5G_MF_eD8LK1CMt733mhyeXubD8aaiOTopnVGEtLJNF5vm-sfX9-QhJBg5nWS0Ti7lS2jTC0K12iUnIhyNhq7ujWQOy_tOfg8ezLIKeCL87zIvl9_-Lb_lN98-fh5f3mTq7qmMZed7mXDWUcRy7LpamjaXqme6Uo3qJiUjaQ9h5YPrdRNyRqqByYHqDsEVmN1kb069S7e_VwxRHFwq7fppKA1b0vWVTWkVHVKKe9C8DiIxZtZ-ntRgthci4N4cC021wI6kVwn6u2J-oW9G4IymNT9JZPshtOKp36AarvB_z-9N_FB096tNib0_QnFZOpo0Iszro1HFYV25p-P_gE3CKtk</recordid><startdate>202011</startdate><enddate>202011</enddate><creator>Ismail, Hamza Y.</creator><creator>Singh, Mehakpreet</creator><creator>Shirazian, Saeed</creator><creator>Albadarin, Ahmad B.</creator><creator>Walker, Gavin M.</creator><general>Elsevier B.V</general><general>Elsevier</general><general>Elsevier Science Ltd</general><scope>6I.</scope><scope>AAFTH</scope><scope>95M</scope><scope>ABMOY</scope><scope>AOWDO</scope><scope>BLEPL</scope><scope>DTL</scope><scope>AAYXX</scope><scope>CITATION</scope><scope>7SR</scope><scope>8FD</scope><scope>JG9</scope><orcidid>https://orcid.org/0000-0002-6392-6068</orcidid></search><sort><creationdate>202011</creationdate><title>Development of high-performance hybrid ANN-finite volume scheme (ANN-FVS) for simulation of pharmaceutical continuous granulation</title><author>Ismail, Hamza Y. ; Singh, Mehakpreet ; Shirazian, Saeed ; Albadarin, Ahmad B. ; Walker, Gavin M.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c442t-a9dba58692ee11594057bccb6d3d5ec6aa5a2b8078f7ad51652df6af049e064e3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2020</creationdate><topic>Artificial neural networks</topic><topic>Crystalline cellulose</topic><topic>Engineering</topic><topic>Engineering, Chemical</topic><topic>Finite volume method</topic><topic>Finite volume scheme</topic><topic>Flow velocity</topic><topic>Fluid dynamics</topic><topic>Granular materials</topic><topic>Granulation</topic><topic>Granulators</topic><topic>Mathematical models</topic><topic>Neural networks</topic><topic>Particle size</topic><topic>Particle size distribution</topic><topic>Pharmaceuticals</topic><topic>Population balance model</topic><topic>Population balance models</topic><topic>Process modelling</topic><topic>Robustness (mathematics)</topic><topic>Science & Technology</topic><topic>Simulation</topic><topic>Technology</topic><topic>Twin screw extruders</topic><topic>Twin-screw granulation</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Ismail, Hamza Y.</creatorcontrib><creatorcontrib>Singh, Mehakpreet</creatorcontrib><creatorcontrib>Shirazian, Saeed</creatorcontrib><creatorcontrib>Albadarin, Ahmad B.</creatorcontrib><creatorcontrib>Walker, Gavin M.</creatorcontrib><collection>ScienceDirect Open Access Titles</collection><collection>Elsevier:ScienceDirect:Open Access</collection><collection>Conference Proceedings Citation Index - Science (CPCI-S)</collection><collection>Conference Proceedings Citation Index - Science (CPCI-S) 2020</collection><collection>Web of Science - Science Citation Index Expanded - 2020</collection><collection>Web of Science Core Collection</collection><collection>Science Citation Index Expanded</collection><collection>CrossRef</collection><collection>Engineered Materials Abstracts</collection><collection>Technology Research Database</collection><collection>Materials Research Database</collection><jtitle>Chemical engineering research & design</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Ismail, Hamza Y.</au><au>Singh, Mehakpreet</au><au>Shirazian, Saeed</au><au>Albadarin, Ahmad B.</au><au>Walker, Gavin M.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Development of high-performance hybrid ANN-finite volume scheme (ANN-FVS) for simulation of pharmaceutical continuous granulation</atitle><jtitle>Chemical engineering research & design</jtitle><stitle>CHEM ENG RES DES</stitle><date>2020-11</date><risdate>2020</risdate><volume>163</volume><spage>320</spage><epage>326</epage><pages>320-326</pages><issn>0263-8762</issn><eissn>1744-3563</eissn><abstract>•Continuous wet granulation of pharmaceutical formulations.•Compartmental modelling of twin screw granulation using population balance.•Development of hybrid ANN-finite volume scheme to solve the model.•Studying the effect of numerical method for solving compartmental population balance models.
A hybrid model was developed for simulation of continuous wet granulation of pharmaceutical formulations via twin-screw granulator. The model was based on population balance model (PBM) for prediction of particle size distribution, while artificial neural network (ANN) was used for estimation of mean residence time which is required for numerical solution of PBM. A new numerical scheme based on finite volume approach was developed for solution of one dimensional PBM to predict granule size distribution obtained in a twin-screw granulator. The model takes into account liquid and feed flow rates, and screw speed, while the granule size distribution is the model's main output. Aggregation and breakage were considered as the main mechanisms in the process, and the model was developed and solved for different zones of extruder, i.e. conveying and kneading ones. The model's predictions were validated through comparing with experimental data collected using a 12mm twin-screw extruder for granulation of microcrystalline cellulose. The results indicated that the model is facile, robust and valid, which can predict the performance of twin-screw granulator for pharmaceutical formulations.</abstract><cop>AMSTERDAM</cop><pub>Elsevier B.V</pub><doi>10.1016/j.cherd.2020.09.002</doi><tpages>7</tpages><orcidid>https://orcid.org/0000-0002-6392-6068</orcidid><oa>free_for_read</oa></addata></record> |
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subjects | Artificial neural networks Crystalline cellulose Engineering Engineering, Chemical Finite volume method Finite volume scheme Flow velocity Fluid dynamics Granular materials Granulation Granulators Mathematical models Neural networks Particle size Particle size distribution Pharmaceuticals Population balance model Population balance models Process modelling Robustness (mathematics) Science & Technology Simulation Technology Twin screw extruders Twin-screw granulation |
title | Development of high-performance hybrid ANN-finite volume scheme (ANN-FVS) for simulation of pharmaceutical continuous granulation |
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