{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,6,3]],"date-time":"2026-06-03T21:06:43Z","timestamp":1780520803146,"version":"3.54.1"},"reference-count":121,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2026,9,1]],"date-time":"2026-09-01T00:00:00Z","timestamp":1788220800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2026,9,1]],"date-time":"2026-09-01T00:00:00Z","timestamp":1788220800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2026,5,6]],"date-time":"2026-05-06T00:00:00Z","timestamp":1778025600000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"funder":[{"DOI":"10.13039\/100020098","name":"Innovative Medicines Initiative","doi-asserted-by":"publisher","id":[{"id":"10.13039\/100020098","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Computers &amp; Chemical Engineering"],"published-print":{"date-parts":[[2026,9]]},"DOI":"10.1016\/j.compchemeng.2026.109690","type":"journal-article","created":{"date-parts":[[2026,5,6]],"date-time":"2026-05-06T22:59:12Z","timestamp":1778108352000},"page":"109690","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":0,"special_numbering":"C","title":["CADET-Hub: Online platform for biomanufacturing modeling and stability testing"],"prefix":"10.1016","volume":"212","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-2675-9002","authenticated-orcid":false,"given":"Hannah","family":"Lanzrath","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-7845-1966","authenticated-orcid":false,"given":"Xiyan","family":"Li","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3866-3304","authenticated-orcid":false,"given":"Daniel G.","family":"Bracewell","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Eric","family":"Calvosa","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-7954-905X","authenticated-orcid":false,"given":"Antonio Gaetano","family":"Cardillo","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-8395-9430","authenticated-orcid":false,"given":"Didier","family":"Clenet","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0009-0005-4192-5039","authenticated-orcid":false,"given":"Daniel","family":"Espinoza","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Caroline","family":"Forestieri","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-0364-1773","authenticated-orcid":false,"given":"Krist V.","family":"Gernaey","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-8592-4207","authenticated-orcid":false,"given":"Joaqu\u00edn Gomis","family":"Fons","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-9624-5026","authenticated-orcid":false,"given":"Steen","family":"H\u00f8rsholt","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-9799-2808","authenticated-orcid":false,"given":"John Bagterp","family":"J\u00f8rgensen","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-9206-8990","authenticated-orcid":false,"given":"Pierre","family":"Lebrun","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Noemie","family":"Mansois","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4839-1752","authenticated-orcid":false,"given":"William","family":"Martin","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-5737-4167","authenticated-orcid":false,"given":"Irina","family":"Meln","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-8587-7850","authenticated-orcid":false,"given":"Wim","family":"Van Molle","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Laurent","family":"Natalis","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3568-7706","authenticated-orcid":false,"given":"Bernt","family":"Nilsson","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"M\u00f3nica","family":"Perea-V\u00e9lez","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4991-5300","authenticated-orcid":false,"given":"Andrea C.M.E.","family":"Rayat","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-2339-4431","authenticated-orcid":false,"given":"D\u00f6rte","family":"Rother","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-0446-7209","authenticated-orcid":false,"given":"Johannes","family":"Schm\u00f6lder","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Reinhard","family":"Liebers","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-0309-8408","authenticated-orcid":false,"given":"Eric","family":"von Lieres","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.compchemeng.2026.109690_b1","series-title":"AI-powered bioprocess modeling and optimization","author":"Algocell","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b2","series-title":"Ansys fluent - Fluid simulation software","author":"Ansys, Inc.","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b3","series-title":"VVUQ 40: Verification, validation, and uncertainty quantification in computational modeling of medical devices","author":"ASME","year":"2018"},{"key":"10.1016\/j.compchemeng.2026.109690_b4","series-title":"VVUQ 80: Verification, validation, and uncertainty quantification in computational modeling of pharmaceutical products","author":"ASME","year":"2025"},{"key":"10.1016\/j.compchemeng.2026.109690_b5","series-title":"Aspen technologi","author":"Aspen Technology, Inc.","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b6","series-title":"Bayesian Methods in Pharmaceutical Research","first-page":"391","article-title":"Bayesian methods for the design and analysis of stability studies","author":"Avohou","year":"2020"},{"issue":"1","key":"10.1016\/j.compchemeng.2026.109690_b7","doi-asserted-by":"crossref","first-page":"168","DOI":"10.1016\/j.xphs.2015.11.023","article-title":"Integrated application of quality-by-design principles to drug product development: A case study of brivanib alaninate film-coated tablets","volume":"105","author":"Badawy","year":"2016","journal-title":"J. Pharm. Sci."},{"key":"10.1016\/j.compchemeng.2026.109690_b8","series-title":"Basetwo AI","author":"Basetwo Artificial Intelligence Inc.","year":"2026"},{"issue":"47","key":"10.1016\/j.compchemeng.2026.109690_b9","doi-asserted-by":"crossref","first-page":"5659","DOI":"10.1039\/C8AY01695J","article-title":"Analytical quality by design (AQbD) as a multiaddressable platform for co-encapsulating drug assays","volume":"10","author":"Basso","year":"2018","journal-title":"Anal. Methods"},{"key":"10.1016\/j.compchemeng.2026.109690_b10","doi-asserted-by":"crossref","first-page":"2","DOI":"10.1016\/j.jprocont.2007.05.007","article-title":"Economic assessment of advanced process control - A survey and framework","volume":"18","author":"Bauer","year":"2008","journal-title":"J. Process. Control."},{"key":"10.1016\/j.compchemeng.2026.109690_b11","doi-asserted-by":"crossref","DOI":"10.1016\/j.chroma.2021.462412","article-title":"Patterns of protein adsorption in ion-exchange particles and columns: Evolution of protein concentration profiles during load, hold, and wash steps predicted for pore and solid diffusion mechanisms","volume":"1653","author":"Beck","year":"2021","journal-title":"J. Chromatogr. A"},{"issue":"6","key":"10.1016\/j.compchemeng.2026.109690_b12","doi-asserted-by":"crossref","first-page":"1271","DOI":"10.1002\/bit.260240604","article-title":"Shear disruption of soya protein precipitate particles and the effect of aging in a stirred tank","volume":"24","author":"Bell","year":"1982","journal-title":"Biotechnol. Bioeng."},{"key":"10.1016\/j.compchemeng.2026.109690_b13","series-title":"Biopharm services","author":"Biopharm Services Ltd.","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b14","doi-asserted-by":"crossref","first-page":"2908","DOI":"10.1016\/j.csbj.2020.10.004","article-title":"Flow-following sensor devices: A tool for bridging data and model predictions in large-scale fermentations","volume":"18","author":"Bisgaard","year":"2020","journal-title":"Comput. Struct. Biotechnol. J."},{"key":"10.1016\/j.compchemeng.2026.109690_b15","doi-asserted-by":"crossref","first-page":"148","DOI":"10.1016\/j.compchemeng.2013.04.013","article-title":"Effects of uncertainties in experimental conditions on the estimation of adsorption model parameters in preparative chromatography","volume":"55","author":"Borg","year":"2013","journal-title":"Comput. & Chem. Eng."},{"issue":"6","key":"10.1016\/j.compchemeng.2026.109690_b16","doi-asserted-by":"crossref","first-page":"385","DOI":"10.1007\/s00449-003-0328-y","article-title":"Performance prediction of industrial centrifuges using scale-down models.","volume":"26","author":"Boychyn","year":"2004","journal-title":"Bioprocess Biosyst. Eng."},{"issue":"16","key":"10.1016\/j.compchemeng.2026.109690_b17","doi-asserted-by":"crossref","first-page":"4759","DOI":"10.1016\/S0009-2509(01)00139-7","article-title":"Characterization of flow intensity in continuous centrifuges for the development of laboratory mimics","volume":"56","author":"Boychyn","year":"2001","journal-title":"Chem. Eng. Sci."},{"key":"10.1016\/j.compchemeng.2026.109690_b18","doi-asserted-by":"crossref","DOI":"10.1016\/j.compchemeng.2023.108340","article-title":"Spatial discontinuous Galerkin spectral element method for a family of chromatography models in CADET","volume":"177","author":"Breuer","year":"2023","journal-title":"Comput. Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b19","doi-asserted-by":"crossref","first-page":"2604","DOI":"10.1002\/bit.28703","article-title":"Vaccine process technology - A decade of progress","volume":"121","author":"Buckland","year":"2024","journal-title":"Biotechnol. Bioeng."},{"key":"10.1016\/j.compchemeng.2026.109690_b20","series-title":"Statistical Applications for Chemistry, Manufacturing and Controls (CMC) in the Pharmaceutical Industry","first-page":"11","article-title":"Statistical methods for CMC applications","author":"Burdick","year":"2017"},{"key":"10.1016\/j.compchemeng.2026.109690_b21","series-title":"Lumped rate model with pores (LRMP)","author":"CADET-Core Documentation","year":"2025"},{"key":"10.1016\/j.compchemeng.2026.109690_b22","series-title":"Multi component langmuir","author":"CADET-Core Documentation","year":"2025"},{"key":"10.1016\/j.compchemeng.2026.109690_b23","series-title":"General rate model","author":"CADET-Core Documentation","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b24","series-title":"Generalized ion exchange","author":"CADET-Core Documentation","year":"2026"},{"issue":"05","key":"10.1016\/j.compchemeng.2026.109690_b25","doi-asserted-by":"crossref","first-page":"281","DOI":"10.18609\/vac.2022.040","article-title":"Stability assessment for vaccines: recent trends & learnings from accelerated scenarios","volume":"01","author":"Campa","year":"2022","journal-title":"Vaccine Insights"},{"issue":"10","key":"10.1016\/j.compchemeng.2026.109690_b26","doi-asserted-by":"crossref","first-page":"1114","DOI":"10.3390\/vaccines9101114","article-title":"Use of stability modeling to support accelerated vaccine development and supply","volume":"9","author":"Campa","year":"2021","journal-title":"Vaccines"},{"key":"10.1016\/j.compchemeng.2026.109690_b27","article-title":"An automatic method for generation of CFD-based 3D compartment models: Towards real-time mixing simulations","volume":"11","author":"Carfort","year":"2024","journal-title":"Bioengineering"},{"issue":"11","key":"10.1016\/j.compchemeng.2026.109690_b28","doi-asserted-by":"crossref","first-page":"3398","DOI":"10.1021\/ja025322c","article-title":"Scale-up and optimization in preparative chromatography: Principles and biopharmaceutical applications","volume":"125","author":"Carta","year":"2003","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.compchemeng.2026.109690_b29","doi-asserted-by":"crossref","DOI":"10.1002\/9783527630158.ch10","article-title":"Protein chromatography: Process development and scale-up","author":"Carta","year":"2010","journal-title":"Protein Chromatogr.: Process. Dev. Scale-Up"},{"issue":"8","key":"10.1016\/j.compchemeng.2026.109690_b30","doi-asserted-by":"crossref","DOI":"10.1208\/s12249-023-02695-5","article-title":"A Bayesian approach to kinetic modeling of accelerated stability studies and shelf life determination","volume":"24","author":"Chau","year":"2023","journal-title":"AAPS PharmSciTech"},{"key":"10.1016\/j.compchemeng.2026.109690_b31","series-title":"ChemAI","author":"ChemAI","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b32","article-title":"Comparing model-based control strategies for a quadruple tank system: Decentralized PID, LMPC, and NMPC","author":"Christensen","year":"2025","journal-title":"J. Process Control"},{"key":"10.1016\/j.compchemeng.2026.109690_b33","doi-asserted-by":"crossref","first-page":"76","DOI":"10.1016\/j.ejpb.2018.01.005","article-title":"Accurate prediction of vaccine stability under real storage conditions and during temperature excursions","volume":"125","author":"Cl\u00e9net","year":"2018","journal-title":"Eur. J. Pharmaceut. Biopharmaceut."},{"key":"10.1016\/j.compchemeng.2026.109690_b34","doi-asserted-by":"crossref","first-page":"284","DOI":"10.1016\/j.ces.2014.03.010","article-title":"A model based approach for identifying robust operating conditions for industrial chromatography with process variability","volume":"116","author":"Close","year":"2014","journal-title":"Chem. Eng. Sci."},{"key":"10.1016\/j.compchemeng.2026.109690_b35","series-title":"GoSilico","author":"Cytiva","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b36","doi-asserted-by":"crossref","DOI":"10.1016\/j.tibtech.2022.03.012","article-title":"Quality by design for enabling RNA platform production processes","author":"Daniel","year":"2022","journal-title":"Trends Biotechnol."},{"key":"10.1016\/j.compchemeng.2026.109690_b37","series-title":"Inno4Vac-CADET-example","author":"Daniel Espinoza","year":"2025"},{"key":"10.1016\/j.compchemeng.2026.109690_b38","doi-asserted-by":"crossref","first-page":"328","DOI":"10.1016\/j.conengprac.2011.12.004","article-title":"MPC: Current practice and challenges","volume":"20","author":"Darby","year":"2012","journal-title":"Control Eng. Pract."},{"key":"10.1016\/j.compchemeng.2026.109690_b39","doi-asserted-by":"crossref","first-page":"76","DOI":"10.1016\/j.ces.2013.11.033","article-title":"CFD-based compartment model for description of mixing in bioreactors","volume":"106","author":"Delafosse","year":"2014","journal-title":"Chem. Eng. Sci."},{"key":"10.1016\/j.compchemeng.2026.109690_b40","doi-asserted-by":"crossref","first-page":"60","DOI":"10.1016\/j.chroma.2017.09.039","article-title":"Multi-state steric mass action model and case study on complex high loading behavior of mAb on ion exchange tentacle resin","volume":"1525","author":"Diedrich","year":"2017","journal-title":"J. Chromatogr. A"},{"key":"10.1016\/j.compchemeng.2026.109690_b41","doi-asserted-by":"crossref","first-page":"4673","DOI":"10.1021\/acs.molpharmaceut.4c00609","article-title":"Predicting the long-term stability of biologics with short-term data","volume":"21","author":"Dillon","year":"2024","journal-title":"Mol. Pharm."},{"key":"10.1016\/j.compchemeng.2026.109690_b42","series-title":"Open source bioreactor modelling platform","author":"DTUB","year":"2025"},{"key":"10.1016\/j.compchemeng.2026.109690_b43","series-title":"Preliminary QIG Considerations on Process Models","author":"EMA","year":"2024"},{"key":"10.1016\/j.compchemeng.2026.109690_b44","series-title":"Reflection Paper on the Use of Artificial Intelligence (AI) in the Medicinal Product Lifecycle","author":"EMA","year":"2024"},{"key":"10.1016\/j.compchemeng.2026.109690_b45","first-page":"1","article-title":"Control strategy for biopharmaceutical production by model predictive control","volume":"40:e3426","author":"Eslami","year":"2024","journal-title":"Biotechnol. Prog."},{"key":"10.1016\/j.compchemeng.2026.109690_b46","doi-asserted-by":"crossref","DOI":"10.1016\/j.chroma.2024.464805","article-title":"Automatic procedure for modelling, calibration, and optimization of a three-component chromatographic separation","volume":"1720","author":"Espinoza","year":"2024","journal-title":"J. Chromatogr. A"},{"key":"10.1016\/j.compchemeng.2026.109690_b47","series-title":"Meeting report: 2nd listen and learn focus group (LLFG) meeting. quality innovation group (QIG), 12\u201313 October 2023, hybrid (EMA\/455426\/2023)","author":"European Medicines Agency","year":"2023"},{"issue":"2","key":"10.1016\/j.compchemeng.2026.109690_b48","doi-asserted-by":"crossref","first-page":"375","DOI":"10.3390\/pharmaceutics14020375","article-title":"Long-term stability prediction for developability assessment of biopharmaceutics using advanced kinetic modeling","volume":"14","author":"Evers","year":"2022","journal-title":"Pharmaceutics"},{"key":"10.1016\/j.compchemeng.2026.109690_b49","series-title":"Artificial Intelligence in Drug Manufacturing and Using Artificial Intelligence and Machine Learning in the Development of Drug and Biological Products","author":"FDA","year":"2023"},{"key":"10.1016\/j.compchemeng.2026.109690_b50","series-title":"Assessing the credibility of computational modeling and simulation in medical device submissions","author":"FDA","year":"2023"},{"key":"10.1016\/j.compchemeng.2026.109690_b51","series-title":"Considerations for the use of artificial intelligence to support regulatory decision-making for drug and biological products","author":"FDA","year":"2025"},{"issue":"S1","key":"10.1016\/j.compchemeng.2026.109690_b52","doi-asserted-by":"crossref","DOI":"10.1365\/s10337-004-0288-7","article-title":"Comparison of the kinetic models of linear chromatography","volume":"60","author":"Felinger","year":"2004","journal-title":"Chromatographia"},{"issue":"1","key":"10.1016\/j.compchemeng.2026.109690_b53","doi-asserted-by":"crossref","first-page":"38","DOI":"10.1016\/j.memsci.2005.12.008","article-title":"A review of factors affecting filter cake properties in dead-end microfiltration of microbial suspensions","volume":"274","author":"Foley","year":"2006","journal-title":"J. Membr. Sci."},{"key":"10.1016\/j.compchemeng.2026.109690_b54","doi-asserted-by":"crossref","DOI":"10.1016\/j.compchemeng.2024.108913","article-title":"CADET-Julia: Efficient and versatile, open-source simulator for batch chromatography in Julia","volume":"192","author":"Frandsen","year":"2025","journal-title":"Comput. Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b55","series-title":"Mathematical Modeling and Scale-up of Liquid Chromatography","author":"Gu","year":"1995"},{"key":"10.1016\/j.compchemeng.2026.109690_b56","series-title":"Fundamentals of Preparative and Nonlinear Chromatography","article-title":"Fundamentals of preparative and nonlinear chromatography \/ Georges Guiochon, Attila Felinger, Dean G. Shirazi, Anita M. Katti","author":"Guiochon","year":"2006"},{"key":"10.1016\/j.compchemeng.2026.109690_b57","article-title":"Statistical intervals","author":"Hahn","year":"1991","journal-title":"Wiley Ser. Probab. Stat."},{"key":"10.1016\/j.compchemeng.2026.109690_b58","doi-asserted-by":"crossref","first-page":"106","DOI":"10.1016\/j.compchemeng.2017.12.007","article-title":"Challenges and opportunities in biopharmaceutical manufacturing","volume":"110","author":"Hong","year":"2018","journal-title":"Comput. Chem. Eng."},{"issue":"1","key":"10.1016\/j.compchemeng.2026.109690_b59","doi-asserted-by":"crossref","DOI":"10.1038\/s41598-023-35870-6","article-title":"A universal tool for stability predictions of biotherapeutics, vaccines and in vitro diagnostic products","volume":"13","author":"Huelsmeyer","year":"2023","journal-title":"Sci. Rep."},{"issue":"3","key":"10.1016\/j.compchemeng.2026.109690_b60","doi-asserted-by":"crossref","DOI":"10.1002\/biot.201600336","article-title":"Modeling of complex antibody elution behavior under high protein load densities in ion exchange chromatography using an asymmetric activity coefficient","volume":"12","author":"Huuk","year":"2017","journal-title":"Biotechnol. J."},{"key":"10.1016\/j.compchemeng.2026.109690_b61","series-title":"Q8-10 Points to Consider (PTC) document","author":"ICH","year":"2011"},{"key":"10.1016\/j.compchemeng.2026.109690_b62","series-title":"Q13 continuous manufacturing","author":"ICH","year":"2023"},{"key":"10.1016\/j.compchemeng.2026.109690_b63","series-title":"Simulation, design, and scheduling tools for the process manufacturing industries","author":"Intelligen, Inc.","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b64","series-title":"Invert - Bioprocess AI software","author":"Invert, Inc.","year":"2026"},{"issue":"5","key":"10.1016\/j.compchemeng.2026.109690_b65","doi-asserted-by":"crossref","first-page":"437","DOI":"10.1177\/2211068214529288","article-title":"Automated and online characterization of adherent cell culture growth in a microfabricated bioreactor","volume":"19","author":"Jaccard","year":"2014","journal-title":"SLAS Technol."},{"key":"10.1016\/j.compchemeng.2026.109690_b66","doi-asserted-by":"crossref","first-page":"137","DOI":"10.1016\/j.ejpb.2021.01.003","article-title":"Model predictive control in pharmaceutical continous manufacturing: A review from a user\u2019s perspective","volume":"159","author":"Jelsch","year":"2021","journal-title":"Eur. J. Pharmaceut. Biopharmaceut."},{"issue":"1","key":"10.1016\/j.compchemeng.2026.109690_b67","doi-asserted-by":"crossref","first-page":"137","DOI":"10.2307\/2530529","article-title":"Bayesian approach to the analysis of nonlinear models: Implementation and evaluation","volume":"37","author":"Katz","year":"1981","journal-title":"Biometrics"},{"key":"10.1016\/j.compchemeng.2026.109690_b68","doi-asserted-by":"crossref","first-page":"237","DOI":"10.1016\/S0021-9673(01)99457-9","article-title":"Contribution to the theory of chromatography","volume":"19","author":"Ku\u010dera","year":"1965","journal-title":"J. Chromatogr. A"},{"key":"10.1016\/j.compchemeng.2026.109690_b69","doi-asserted-by":"crossref","DOI":"10.1016\/j.chroma.2021.462669","article-title":"Robust mechanistic modeling of protein ion-exchange chromatography","volume":"1660","author":"Kumar","year":"2021","journal-title":"J. Chromatogr. A"},{"issue":"11","key":"10.1016\/j.compchemeng.2026.109690_b70","doi-asserted-by":"crossref","first-page":"2221","DOI":"10.1021\/ja02268a002","article-title":"The constitution and fundamental properties of solids and liquids. Part I. Solids","volume":"38","author":"Langmuir","year":"1916","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.compchemeng.2026.109690_b71","series-title":"CADET-Hub","author":"Lanzrath","year":"2026"},{"issue":"111","key":"10.1016\/j.compchemeng.2026.109690_b72","doi-asserted-by":"crossref","first-page":"7881","DOI":"10.21105\/joss.07881","article-title":"CADET-core 5.0: High-performance solver for advanced Biotechnology process modeling","volume":"10","author":"Leweke","year":"2025","journal-title":"J. Open Source Softw."},{"key":"10.1016\/j.compchemeng.2026.109690_b73","doi-asserted-by":"crossref","first-page":"274","DOI":"10.1016\/j.compchemeng.2018.02.025","article-title":"Chromatography analysis and design toolkit (CADET)","volume":"113","author":"Leweke","year":"2018","journal-title":"Comput. & Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b74","article-title":"A cloud-enabled digital twin platform for upstream processing in biotechnology: Integrating CFD, compartmentalization, and reaction kinetics","volume":"206","author":"Li","year":"2025","journal-title":"Comput. & Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b75","doi-asserted-by":"crossref","DOI":"10.1016\/j.compchemeng.2025.109488","article-title":"A cloud-enabled digital twin platform for upstream processing in biotechnology: Integrating CFD, compartmentalization, and reaction kinetics","volume":"206","author":"Li","year":"2026","journal-title":"Comput. Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b76","series-title":"DTUB repository","author":"Lund","year":"2025"},{"key":"10.1016\/j.compchemeng.2026.109690_b77","series-title":"M-star CFD","author":"M-Star Simulations, LLC","year":"2026"},{"issue":"8","key":"10.1016\/j.compchemeng.2026.109690_b78","doi-asserted-by":"crossref","first-page":"2333","DOI":"10.1016\/j.drudis.2022.05.001","article-title":"Collaborative university-industry R&D practices supporting the pharmaceutical innovation process: Insights from a bibliometric review","volume":"27","author":"Ma","year":"2022","journal-title":"Drug Discov. Today"},{"key":"10.1016\/j.compchemeng.2026.109690_b79","doi-asserted-by":"crossref","DOI":"10.1016\/j.vaccine.2025.127170","article-title":"Advancing regulatory dialogue: In silico models for improved vaccine biomanufacturing - an expert meeting report","volume":"56","author":"Meln","year":"2025","journal-title":"Vaccine"},{"key":"10.1016\/j.compchemeng.2026.109690_b80","series-title":"Merck group","author":"Merck KGaA","year":"2026"},{"issue":"6","key":"10.1016\/j.compchemeng.2026.109690_b81","doi-asserted-by":"crossref","first-page":"864","DOI":"10.1002\/ceat.200800082","article-title":"A review of the thermodynamics of protein association to ligands, protein adsorption, and adsorption isotherms","volume":"31","author":"Mollerup","year":"2008","journal-title":"Chem. Eng. & Technol."},{"key":"10.1016\/j.compchemeng.2026.109690_b82","doi-asserted-by":"crossref","DOI":"10.1016\/j.cej.2021.130402","article-title":"Development of dynamic compartment models for industrial aerobic fed-batch fermentation processes","volume":"420","author":"Nadal-Rey","year":"2021","journal-title":"Chem. Eng. J."},{"key":"10.1016\/j.compchemeng.2026.109690_b83","series-title":"New wave Biotech","author":"New Wave Biotech Ltd.","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b84","doi-asserted-by":"crossref","DOI":"10.1016\/j.ijpharm.2021.121143","article-title":"Predictive modeling for assessing the long-term thermal stability of a new fully-liquid quadrivalent meningococcal tetanus toxoid conjugated vaccine","volume":"609","author":"Neyra","year":"2021","journal-title":"Int. J. Pharm."},{"key":"10.1016\/j.compchemeng.2026.109690_b85","doi-asserted-by":"crossref","first-page":"61","DOI":"10.1016\/j.fbp.2023.02.008","article-title":"Integrated ultra scale-down and multivariate analysis of flocculation and centrifugation for enhanced primary recovery","volume":"139","author":"Nunes","year":"2023","journal-title":"Food Bioprod. Process."},{"key":"10.1016\/j.compchemeng.2026.109690_b86","doi-asserted-by":"crossref","first-page":"506","DOI":"10.1016\/j.jpba.2017.06.020","article-title":"Life cycle management of analytical methods","volume":"147","author":"Parr","year":"2018","journal-title":"J. Pharm. Biomed. Anal."},{"key":"10.1016\/j.compchemeng.2026.109690_b87","doi-asserted-by":"crossref","DOI":"10.1155\/2015\/868727","article-title":"Analytical quality by design: a tool for regulatory flexibility and robust analytics","volume":"2015","author":"Peraman","year":"2015","journal-title":"Int. J. Anal. Chem."},{"issue":"5","key":"10.1016\/j.compchemeng.2026.109690_b88","doi-asserted-by":"crossref","first-page":"959","DOI":"10.1080\/10543400802278197","article-title":"A Bayesian approach to the ICH Q8 definition of design space","volume":"18","author":"Peterson","year":"2008","journal-title":"J. Biopharm. Statist."},{"issue":"6","key":"10.1016\/j.compchemeng.2026.109690_b89","doi-asserted-by":"crossref","first-page":"889","DOI":"10.1080\/03639045.2017.1291672","article-title":"Design of experiments (DoE) in pharmaceutical development","volume":"43","author":"Politis","year":"2017","journal-title":"Drug Dev. Ind. Pharm."},{"key":"10.1016\/j.compchemeng.2026.109690_b90","doi-asserted-by":"crossref","first-page":"152","DOI":"10.1016\/j.ces.2015.08.050","article-title":"Utilizing algorithmic differentiation to efficiently compute chromatograms and parameter sensitivities","volume":"139","author":"P\u00fcttmann","year":"2016","journal-title":"Chem. Eng. Sci."},{"key":"10.1016\/j.compchemeng.2026.109690_b91","doi-asserted-by":"crossref","first-page":"733","DOI":"10.1016\/S0967-0661(02)00186-7","article-title":"A survey of industrial model predictive control technology","volume":"11","author":"Qin","year":"2003","journal-title":"Control Eng. Pract."},{"key":"10.1016\/j.compchemeng.2026.109690_b92","doi-asserted-by":"crossref","DOI":"10.1016\/j.coche.2023.100998","article-title":"Accelerating vaccine manufacturing development through model-based approaches: current advances and future opportunities","volume":"43","author":"Ramin","year":"2024","journal-title":"Curr. Opin. Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b93","doi-asserted-by":"crossref","first-page":"150","DOI":"10.1016\/j.coche.2016.09.012","article-title":"Ultra scale-down approaches to enhance the creation of bioprocesses at scale: impacts of process shear stress and early recovery stages","volume":"14","author":"Rayat","year":"2016","journal-title":"Curr. Opin. Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b94","doi-asserted-by":"crossref","first-page":"31","DOI":"10.1016\/j.tca.2014.01.005","article-title":"Prediction of thermal stability of materials by modified kinetic and model selection approaches based on limited amount of experimental points","volume":"579","author":"Roduit","year":"2014","journal-title":"Thermochim. Acta"},{"key":"10.1016\/j.compchemeng.2026.109690_b95","doi-asserted-by":"crossref","first-page":"157","DOI":"10.1016\/j.trac.2012.09.007","article-title":"Design spaces for analytical methods","volume":"42","author":"Rozet","year":"2013","journal-title":"TRAC Trends Anal. Chem."},{"key":"10.1016\/j.compchemeng.2026.109690_b96","series-title":"Sartobran p 0.2 \u03bcm - Sterilizing-grade filter elements","author":"Sartorius","year":"2025"},{"key":"10.1016\/j.compchemeng.2026.109690_b97","doi-asserted-by":"crossref","DOI":"10.18609\/vac.2025.054","article-title":"Predicting stability of conventional and mRNA-based vaccines","author":"Scaccia","year":"2025","journal-title":"Vaccine Insights"},{"key":"10.1016\/j.compchemeng.2026.109690_b98","series-title":"Scaleup company international","author":"ScaleUp Company International","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b99","doi-asserted-by":"crossref","first-page":"1783","DOI":"10.3390\/pr10091783","article-title":"Process automation and control strategy by quality-by-design in total continuous mRNA manufacturing platforms","volume":"10","author":"Schmidt","year":"2022","journal-title":"Processes"},{"key":"10.1016\/j.compchemeng.2026.109690_b100","doi-asserted-by":"crossref","DOI":"10.3390\/pr8010065","article-title":"A modular framework for the modelling and optimization of advanced chromatographic processes","volume":"8","author":"Schm\u00f6lder","year":"2020","journal-title":"Processes"},{"key":"10.1016\/j.compchemeng.2026.109690_b101","series-title":"CADET-python-simulator","author":"Schm\u00f6lder","year":"2025"},{"issue":"10","key":"10.1016\/j.compchemeng.2026.109690_b102","first-page":"1","article-title":"Analysis of pharma R&D productivity - a new perspective needed","volume":"28","author":"Schumacher","year":"2023","journal-title":"Drug Discov. Today"},{"issue":"2","key":"10.1016\/j.compchemeng.2026.109690_b103","first-page":"52","article-title":"Implications and opportunities of applying QbD principles to analytical measurements. Position paper QbD analytics","volume":"34","author":"Schweitzer","year":"2010","journal-title":"Pharm. Technol. Eur."},{"issue":"6","key":"10.1016\/j.compchemeng.2026.109690_b104","doi-asserted-by":"crossref","first-page":"163","DOI":"10.1016\/j.ifacol.2025.07.139","article-title":"Hybrid optimization methods for parameter estimation of reactive transport systems","volume":"59","author":"Schytt","year":"2025","journal-title":"IFAC-PapersOnLine"},{"issue":"1","key":"10.1016\/j.compchemeng.2026.109690_b105","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/0040-6031(71)85051-7","article-title":"Study of the kinetics of the mechanism of solid-state reactions at increasing temperatures","volume":"3","author":"\u0160est\u00e1k","year":"1971","journal-title":"Thermochim. Acta"},{"key":"10.1016\/j.compchemeng.2026.109690_b106","doi-asserted-by":"crossref","DOI":"10.1016\/j.ijpharm.2025.126301","article-title":"End-to-end digital twin software for continuous mRNA manufacturing","volume":"686","author":"Shahab","year":"2025","journal-title":"Int. J. Pharm."},{"issue":"5","key":"10.1016\/j.compchemeng.2026.109690_b107","doi-asserted-by":"crossref","first-page":"253","DOI":"10.1016\/j.tibtech.2010.02.001","article-title":"Recent advances in large-scale production of monoclonal antibodies and related proteins","volume":"28","author":"Shukla","year":"2010","journal-title":"Trends Biotechnol."},{"key":"10.1016\/j.compchemeng.2026.109690_b108","series-title":"Siemens","author":"Siemens AG","year":"2026"},{"key":"10.1016\/j.compchemeng.2026.109690_b109","doi-asserted-by":"crossref","DOI":"10.1016\/j.bej.2019.107293","article-title":"A compartment model for risk-based monitoring of lactic acid bacteria cultivations","volume":"151","author":"Spann","year":"2019","journal-title":"Biochem. Eng. J."},{"key":"10.1016\/j.compchemeng.2026.109690_b110","doi-asserted-by":"crossref","first-page":"236","DOI":"10.1016\/j.compchemeng.2018.12.015","article-title":"A CFD based automatic method for compartment model development","volume":"123","author":"Tajsoleiman","year":"2019","journal-title":"Comput. & Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b111","doi-asserted-by":"crossref","first-page":"945","DOI":"10.3390\/pr10050945","article-title":"Automation of modeling and calibration of integrated preparative protein chromatograhpy systems","volume":"10","author":"Tallvod","year":"2022","journal-title":"Processes"},{"issue":"9","key":"10.1016\/j.compchemeng.2026.109690_b112","doi-asserted-by":"crossref","first-page":"1784","DOI":"10.1021\/acs.oprd.9b00238","article-title":"Development and optimization of liquid chromatography analytical methods by using AQbD principles: Overview and recent advances","volume":"23","author":"Tome","year":"2019","journal-title":"Org. Process. Res. & Dev."},{"issue":"1","key":"10.1016\/j.compchemeng.2026.109690_b113","doi-asserted-by":"crossref","DOI":"10.1038\/s41541-021-00322-7","article-title":"Quality by design modelling to support rapid RNA vaccine production against emerging infectious diseases","volume":"6","author":"van de Berg","year":"2021","journal-title":"Npj Vaccines"},{"key":"10.1016\/j.compchemeng.2026.109690_b114","doi-asserted-by":"crossref","DOI":"10.1016\/j.ijpharm.2025.125322","article-title":"Data-driven model predictive control for continuous pharmaceutical manufacturing","volume":"672","author":"Vega-Zambrano","year":"2025","journal-title":"Int. J. Pharm."},{"issue":"8","key":"10.1016\/j.compchemeng.2026.109690_b115","doi-asserted-by":"crossref","first-page":"1180","DOI":"10.1016\/j.compchemeng.2010.03.008","article-title":"A fast and accurate solver for the general rate model of column liquid chromatography","volume":"34","author":"von Lieres","year":"2010","journal-title":"Comput. & Chem. Eng."},{"issue":"2","key":"10.1016\/j.compchemeng.2026.109690_b116","doi-asserted-by":"crossref","first-page":"382","DOI":"10.1002\/btpr.2220","article-title":"Evaluation of options for harvest of a recombinant E. coli fermentation producing a domain antibody using ultra scale-down techniques and pilot-scale verification","volume":"32","author":"Voulgaris","year":"2016","journal-title":"Biotechnol. Prog."},{"issue":"5","key":"10.1016\/j.compchemeng.2026.109690_b117","doi-asserted-by":"crossref","first-page":"263","DOI":"10.1007\/BF00369924","article-title":"The use of windows of operation as a bioprocess design tool","volume":"14","author":"Woodley","year":"1996","journal-title":"Bioprocess Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b118","series-title":"Ypsomed","author":"Ypsomed Holding A.G.","year":"2026"},{"issue":"4","key":"10.1016\/j.compchemeng.2026.109690_b119","doi-asserted-by":"crossref","first-page":"771","DOI":"10.1208\/s12248-014-9598-3","article-title":"Understanding pharmaceutical quality by design","volume":"16","author":"Yu","year":"2014","journal-title":"AAPS J."},{"key":"10.1016\/j.compchemeng.2026.109690_b120","doi-asserted-by":"crossref","DOI":"10.1016\/j.compchemeng.2024.108860","article-title":"Solving crystallization\/precipitation population balance models in CADET, Part II: Size-based Smoluchowski coagulation and fragmentation equations in batch and continuous modes","volume":"192","author":"Zhang","year":"2025","journal-title":"Comput. Chem. Eng."},{"key":"10.1016\/j.compchemeng.2026.109690_b121","doi-asserted-by":"crossref","DOI":"10.1016\/j.compchemeng.2024.108612","article-title":"Solving crystallization\/precipitation population balance models in CADET, part I: Nucleation growth and growth rate dispersion in batch and continuous modes on nonuniform grids","volume":"183","author":"Zhang","year":"2024","journal-title":"Comput. Chem. Eng."}],"container-title":["Computers &amp; Chemical Engineering"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0098135426001432?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0098135426001432?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2026,6,3]],"date-time":"2026-06-03T20:43:48Z","timestamp":1780519428000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0098135426001432"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,9]]},"references-count":121,"alternative-id":["S0098135426001432"],"URL":"https:\/\/doi.org\/10.1016\/j.compchemeng.2026.109690","relation":{},"ISSN":["0098-1354"],"issn-type":[{"value":"0098-1354","type":"print"}],"subject":[],"published":{"date-parts":[[2026,9]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"CADET-Hub: Online platform for biomanufacturing modeling and stability testing","name":"articletitle","label":"Article Title"},{"value":"Computers & Chemical Engineering","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.compchemeng.2026.109690","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2026 The Authors. Published by Elsevier Ltd.","name":"copyright","label":"Copyright"}],"article-number":"109690"}}