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Research Articles

Molecular dynamics simulations of cellulase homologs in aqueous 1-ethyl-3-methylimidazolium chloride

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Pages 1990-2002 | Received 05 May 2016, Accepted 15 Jun 2016, Published online: 08 Jul 2016

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Yuxuan Song, Xiuyun Wu, Yue Zhao, Xukai Jiang & Lushan Wang. (2022) Comparative molecular dynamics simulations identify a salt-sensitive loop responsible for the halotolerant activity of GH5 cellulases. Journal of Biomolecular Structure and Dynamics 40:19, pages 9522-9529.
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Hakim Hebal, Nawel Boucherba, Baris Binay & Ossi Turunen. (2021) Activity and stability of hyperthermostable cellulases and xylanases in ionic liquids. Biocatalysis and Biotransformation 39:4, pages 242-259.
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Articles from other publishers (8)

Rahul Ranjan, Rohit Rai, Smruti B. Bhatt & Prodyut Dhar. (2023) Technological road map of Cellulase: A comprehensive outlook to structural, computational, and industrial applications. Biochemical Engineering Journal 198, pages 109020.
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Manish Paul, Sonali Mohapatra, Pradeep Kumar Das Mohapatra & Hrudayanath Thatoi. (2021) Microbial cellulases – An update towards its surface chemistry, genetic engineering and recovery for its biotechnological potential. Bioresource Technology 340, pages 125710.
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Samantha Summers, Casey Kraft, Sarah Alamdari, Jim Pfaendtner & Joel L. Kaar. (2020) Enhanced Activity and Stability of Acidothermus cellulolyticus Endoglucanase 1 in Ionic Liquids via Engineering Active Site Residues and Non-Native Disulfide Bridges . ACS Sustainable Chemistry & Engineering 8:30, pages 11299-11307.
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Bharat Manna & Amit Ghosh. (2020) Structure and dynamics of ionic liquid tolerant hyperthermophilic endoglucanase Cel12A from Rhodothermus marinus . RSC Advances 10:13, pages 7933-7947.
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Mansi Arora, Ragothaman M. Yennamalli & Taner Z. Sen. (2018) Application of Molecular Simulations Toward Understanding Cellulase Mechanisms. BioEnergy Research 11:4, pages 850-867.
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Betul Uralcan, Sang Beom Kim, Chester E. Markwalter, Robert K. Prud’homme & Pablo G. Debenedetti. (2018) A Computational Study of the Ionic Liquid-Induced Destabilization of the Miniprotein Trp-Cage. The Journal of Physical Chemistry B 122:21, pages 5707-5715.
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Samantha R. Summers, K. G. Sprenger, Jim Pfaendtner, Jan Marchant, Michael F. Summers & Joel L. Kaar. (2017) Mechanism of Competitive Inhibition and Destabilization of Acidothermus cellulolyticus Endoglucanase 1 by Ionic Liquids . The Journal of Physical Chemistry B 121:48, pages 10793-10803.
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Vance W. Jaeger & Jim Pfaendtner. (2016) Destabilization of Human Serum Albumin by Ionic Liquids Studied Using Enhanced Molecular Dynamics Simulations. The Journal of Physical Chemistry B 120:47, pages 12079-12087.
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