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SBMOpenMM: A Builder of Structure-Based Models for OpenMM.
J Chem Inf Model. 2021 Jul 26;61(7):3166-3171. doi: 10.1021/acs.jcim.1c00122. Epub 2021 Jul 12.
J Chem Inf Model. 2021.
PMID: 34251801
Enzyme Conformation Influences the Performance of Lipase-powered Nanomotors.
Wang L, Marciello M, Estévez-Gay M, Soto Rodriguez PED, Luengo Morato Y, Iglesias-Fernández J, Huang X, Osuna S, Filice M, Sánchez S.
Wang L, et al. Among authors: estevez gay m.
Angew Chem Int Ed Engl. 2020 Nov 16;59(47):21080-21087. doi: 10.1002/anie.202008339. Epub 2020 Sep 16.
Angew Chem Int Ed Engl. 2020.
PMID: 32755070
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Estimating conformational heterogeneity of tryptophan synthase with a template-based Alphafold2 approach.
Casadevall G, Duran C, Estévez-Gay M, Osuna S.
Casadevall G, et al. Among authors: estevez gay m.
Protein Sci. 2022 Oct;31(10):e4426. doi: 10.1002/pro.4426.
Protein Sci. 2022.
PMID: 36173176
Free PMC article.
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Insights into the molecular determinants of thermal stability in halohydrin dehalogenase HheD2.
Wessel J, Petrillo G, Estevez-Gay M, Bosch S, Seeger M, Dijkman WP, Iglesias-Fernández J, Hidalgo A, Uson I, Osuna S, Schallmey A.
Wessel J, et al. Among authors: estevez gay m.
FEBS J. 2021 Aug;288(15):4683-4701. doi: 10.1111/febs.15777. Epub 2021 Mar 24.
FEBS J. 2021.
PMID: 33605544
Free article.
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