Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular Docking

In this work, dyed samples were self-prepared from two methods including madder dyeing and mordant dyeing by madder combined with Al3+ at different temperatures, and their kinetics and isothermal adsorption were both discussed. Weber–Morris diffusion model and Freundlich model were found to be more...

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Main Authors: Yujie Guo, Xudong Zhou, Lingfan Zhang, Xiyun Luo, Mengqi Wu, Wenqing Zhang
Format: Article
Language:English
Published: Taylor & Francis Group 2024-12-01
Series:Journal of Natural Fibers
Subjects:
Online Access:https://www.tandfonline.com/doi/10.1080/15440478.2024.2324302
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author Yujie Guo
Xudong Zhou
Lingfan Zhang
Xiyun Luo
Mengqi Wu
Wenqing Zhang
author_facet Yujie Guo
Xudong Zhou
Lingfan Zhang
Xiyun Luo
Mengqi Wu
Wenqing Zhang
author_sort Yujie Guo
collection DOAJ
description In this work, dyed samples were self-prepared from two methods including madder dyeing and mordant dyeing by madder combined with Al3+ at different temperatures, and their kinetics and isothermal adsorption were both discussed. Weber–Morris diffusion model and Freundlich model were found to be more suitable in dyeing for kinetics and thermodynamics. Through SEM, FTIR and fastness tests, the dyeing performances were displayed and the possible structure between madder dyes and the complex with Al3+ were illustrated. By molecular docking, madder dyes showed combination with glutamic acid predominantly. After introducing metal ion, the shortage of hydrogen bonds length was observed. It was initially employed to elucidate the potential binding modes between dyes and proteinaceous fibers. Overall, through experimental dyeing and curve fitting, this study provided insights into the dyeing mechanism of madder-associated dyestuffs on silk. Moreover, molecular docking elucidated the dyeing mechanism further, highlighting that the presence of metal ion enhances the firmness of the staining. The elucidation of dyeing mechanism not only provided valuable theoretical support for color restoration but also shed light on the practically modify of methods in obtaining ideal color. These results could serve as inspiration for conservators to maintain the vibrancy and longevity of dyed silks.
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spelling doaj.art-55e0d90c923b417b86ae0d22dc7a43372024-12-09T14:41:33ZengTaylor & Francis GroupJournal of Natural Fibers1544-04781544-046X2024-12-0121110.1080/15440478.2024.2324302Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular DockingYujie Guo0Xudong Zhou1Lingfan Zhang2Xiyun Luo3Mengqi Wu4Wenqing Zhang5School of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai, P. R. ChinaSchool of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai, P. R. ChinaSchool of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai, P. R. ChinaState Administration for Cultural Heritage, Shanghai Museum, Shanghai, P. R. ChinaSchool of Pharmacy, East China University of Science and Technology, Shanghai, P. R. ChinaSchool of Chemistry and Molecular Engineering, East China University of Science and Technology, Shanghai, P. R. ChinaIn this work, dyed samples were self-prepared from two methods including madder dyeing and mordant dyeing by madder combined with Al3+ at different temperatures, and their kinetics and isothermal adsorption were both discussed. Weber–Morris diffusion model and Freundlich model were found to be more suitable in dyeing for kinetics and thermodynamics. Through SEM, FTIR and fastness tests, the dyeing performances were displayed and the possible structure between madder dyes and the complex with Al3+ were illustrated. By molecular docking, madder dyes showed combination with glutamic acid predominantly. After introducing metal ion, the shortage of hydrogen bonds length was observed. It was initially employed to elucidate the potential binding modes between dyes and proteinaceous fibers. Overall, through experimental dyeing and curve fitting, this study provided insights into the dyeing mechanism of madder-associated dyestuffs on silk. Moreover, molecular docking elucidated the dyeing mechanism further, highlighting that the presence of metal ion enhances the firmness of the staining. The elucidation of dyeing mechanism not only provided valuable theoretical support for color restoration but also shed light on the practically modify of methods in obtaining ideal color. These results could serve as inspiration for conservators to maintain the vibrancy and longevity of dyed silks.https://www.tandfonline.com/doi/10.1080/15440478.2024.2324302Madder-associated dyesmadder dyeingmordant dyeingkineticsthermodynamicsmolecular docking
spellingShingle Yujie Guo
Xudong Zhou
Lingfan Zhang
Xiyun Luo
Mengqi Wu
Wenqing Zhang
Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular Docking
Journal of Natural Fibers
Madder-associated dyes
madder dyeing
mordant dyeing
kinetics
thermodynamics
molecular docking
title Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular Docking
title_full Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular Docking
title_fullStr Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular Docking
title_full_unstemmed Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular Docking
title_short Experimental and Theoretical Study of Madder-Associated Dyestuffs on Silk: Adsorption of Kinetics, Thermodynamics and Molecular Docking
title_sort experimental and theoretical study of madder associated dyestuffs on silk adsorption of kinetics thermodynamics and molecular docking
topic Madder-associated dyes
madder dyeing
mordant dyeing
kinetics
thermodynamics
molecular docking
url https://www.tandfonline.com/doi/10.1080/15440478.2024.2324302
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