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  1. CIME4R: Exploring iterative, AI-guided chemical reaction optimization campaigns in their parameter space

    Abstract

    Chemical reaction optimization (RO) is an iterative process that results in large, high-dimensional datasets. Current tools allow for only...

    Christina Humer, Rachel Nicholls, ... Marc Streit in Journal of Cheminformatics
    Article Open access 10 May 2024
  2. Optimization and simultaneous heat integration design of a coal-based ethylene glycol refining process by a parallel differential evolution algorithm

    Coal to ethylene glycol still lacks algorithm optimization achievements for distillation sequencing due to high-dimension and strong nonconvexity...

    Jiahao Wang, Hao Lyu, ... **sheng Sun in Frontiers of Chemical Science and Engineering
    Article 03 May 2023
  3. Decision support for the development, simulation and optimization of dynamic process models

    Simulation is besides experimentation the major method for designing, analyzing and optimizing chemical processes. The ability of simulations to...

    Norbert Asprion, Roger Böttcher, ... Michael Bortz in Frontiers of Chemical Science and Engineering
    Article 29 April 2021
  4. Optimization of Arabinogalactan Sulfation in Process Scaling

    Abstract

    To ensure the safety of the arabinogalactan sulfation process, the thermal effect of the reaction (148.26 kJ) was determined by the thermal...

    Article 01 January 2023
  5. Conceptual process and surrogate optimization of acrylonitrile production from glycerol via green propylene

    Acrylonitrile is a commodity currently produced from petrochemical propylene, with significant economic importance. The development of a sustainable...

    Gabriel N. Guerra, Guilherme J. Musse Neto, ... Luiz A. M. Pontes in Brazilian Journal of Chemical Engineering
    Article 16 August 2023
  6. Adsorption/desorption behavior and purification process optimization of theaflavins on macroporous resin

    Theaflavins, as products of tea fermentation, exhibit significant applications in the fields of functional food, medicine, and others. This study...

    Yangjie Han, Beiqi Wu, ... Hongxin Wang in Journal of Food Measurement and Characterization
    Article 12 July 2024
  7. Generation of DNA oligomers with similar chemical kinetics via in-silico optimization

    Networks of interacting DNA oligomers are useful for applications such as biomarker detection, targeted drug delivery, information storage, and...

    Michael Tobiason, Bernard Yurke, William L. Hughes in Communications Chemistry
    Article Open access 18 October 2023
  8. Hybrid method integrating machine learning and particle swarm optimization for smart chemical process operations

    Modeling and optimization is crucial to smart chemical process operations. However, a large number of nonlinearities must be considered in a typical...

    Haoqin Fang, Jianzhao Zhou, ... Ming Pan in Frontiers of Chemical Science and Engineering
    Article 29 April 2021
  9. Synthesis of hydroxyapatite/polyethylene glycol 6000 composites by novel dissolution/precipitation method: optimization of the adsorption process using a factorial design: DFT and molecular dynamic

    In this work, we presented a synthesis of a composite based on HAp and PEG 6000 using a new method of synthesis dissolution precipitation to be...

    K. Azzaoui, S. Jodeh, ... M. Algarra in BMC Chemistry
    Article Open access 08 November 2023
  10. Dynamic simulation and control of a triple column process for dimethyl carbonate-methanol separation

    Separation of dimethyl carbonate/methanol azeotropic mixture by using pressure-swing distillation process has been a hot-point in the study of the...

    Hong-Mei Wei, Qiang Gao, ... Wei Wei in Korean Journal of Chemical Engineering
    Article 17 November 2022
  11. Exploring advanced process equipment visualization as a step towards digital twins development in the chemical industry: A CFD-DNN approach

    Several studies involving the implementation of artificial neural network (ANN) technology for process design, monitoring, and control are under...

    Dela Quarme Gbadago, Jiyoung Moon, Sungwon Hwang in Korean Journal of Chemical Engineering
    Article 04 January 2023
  12. Software: Tools for Optimization

    This chapter emphasizes the importance of integrating optimization tools in engineering education, it enhances students’ knowledge and skills to...
    José María Ponce-Ortega, Rogelio Ochoa-Barragán, César Ramírez-Márquez in Optimization of Chemical Processes
    Chapter 2024
  13. Design and optimization of a continuous purification process using ion-exchange periodic counter-current chromatography for a low-titer enzyme

    A continuous purification process can be beneficial to the purification of biologics due to its higher productivity and efficiency than a...

    Kwanyoung Ko, Min-Jung Kim, ... Sangho Lee in Biotechnology and Bioprocess Engineering
    Article Open access 04 April 2024
  14. Chemical loo** reforming: process fundamentals and oxygen carriers

    Chemical loo** reforming (CLR) provides a viable process intensification approach for clean and efficient syngas production from carbonaceous fuel...

    Hao Zheng, **aofeng Jiang, ... Liang Zeng in Discover Chemical Engineering
    Article Open access 25 July 2022
  15. Multi-objective optimization of a methanol synthesis process: CO2 emission vs. economics

    This work addresses the modeling and multi-objective optimization of methanol synthesis to efficiently utilize CO 2 from the CO 2 emissions and...

    Jae Hun Jeong, Seungwoo Kim, ... Won Bo Lee in Korean Journal of Chemical Engineering
    Article 03 June 2022
  16. Dynamic plant-wide process monitoring based on distributed slow feature analysis with inter-unit dissimilarity

    In order to overcome the dynamic and large-scale characteristics of the plant-wide processes, this paper proposed a distributed slow feature analysis...

    Ruoyu Huang, Zetao Li, Bin Cao in Korean Journal of Chemical Engineering
    Article 18 January 2022
  17. Soft sensor development based on just-in-time learning and dynamic time war** for multi-grade processes

    This study presents the development of soft sensors based on just-in-time learning (JITL) and dynamic time war** (DTW) for online quality...

    Min Jun Song, Sung Hyun Ju, Jong Min Lee in Korean Journal of Chemical Engineering
    Article 10 March 2023
  18. A hybrid spatial-temporal deep learning prediction model of industrial methanol-to-olefins process

    Methanol-to-olefins, as a promising non-oil pathway for the synthesis of light olefins, has been successfully industrialized. The accurate prediction...

    Jibin Zhou, Xue Li, ... Zhongmin Liu in Frontiers of Chemical Science and Engineering
    Article 15 March 2024
  19. Comparison of Dynamic Tests of the Modified Purex Process Flowsheet Using 30 and 45% TBF in Isoparaffin

    Abstract

    Results of centrifugal contactor rig trials of the flowsheet of the first solvent extraction cycle in protective glove boxes using simulated...

    A. A. Naumov, N. D. Goletskii, ... A. S. Kudinov in Radiochemistry
    Article 01 February 2024
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