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Mutexa: A Computational Ecosystem for Intelligent Protein Engineering.
J Chem Theory Comput. 2023 Nov 14;19(21):7459-7477. doi: 10.1021/acs.jctc.3c00602. Epub 2023 Oct 12.
J Chem Theory Comput. 2023.
PMID: 37828731
Free PMC article.
Review.
Molecular Dynamics-Derived Descriptor Informs the Impact of Mutation on the Catalytic Turnover Number in Lactonase Across Substrates.
Jiang Y, Yan B, Chen Y, Juarez RJ, Yang ZJ.
Jiang Y, et al. Among authors: juarez rj.
J Phys Chem B. 2022 Apr 7;126(13):2486-2495. doi: 10.1021/acs.jpcb.2c00142. Epub 2022 Mar 24.
J Phys Chem B. 2022.
PMID: 35324218
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LassoHTP: A High-Throughput Computational Tool for Lasso Peptide Structure Construction and Modeling.
Juarez RJ, Jiang Y, Tremblay M, Shao Q, Link AJ, Yang ZJ.
Juarez RJ, et al.
J Chem Inf Model. 2023 Jan 23;63(2):522-530. doi: 10.1021/acs.jcim.2c00945. Epub 2023 Jan 3.
J Chem Inf Model. 2023.
PMID: 36594886
Free PMC article.
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Antimicrobial Lasso Peptide Cloacaenodin Utilizes a Unique TonB-Dependent Transporter to Access Susceptible Bacteria.
Carson DV, Juarez RJ, Do T, Yang ZJ, Link AJ.
Carson DV, et al. Among authors: juarez rj.
ACS Chem Biol. 2024 Apr 19;19(4):981-991. doi: 10.1021/acschembio.4c00009. Epub 2024 Mar 25.
ACS Chem Biol. 2024.
PMID: 38527226
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