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Data from molecular dynamics simulations in support of the role of human CES1 in the hydrolysis of Amplex Red

This data article contains the results of molecular dynamics (MD) simulations performed to assess the stability of the previously computed complex between the hCES1 structure and the Amplex Red (AR) substrate (Miwa et al., 2015) [1] and to compare the dynamic behavior of this complex with that of th...

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Bibliographic Details
Published in:Data Brief
Main Authors: Vistoli, Giulio, Treumann, Achim, Zglinicki, Thomas von, Miwa, Satomi
Format: Artigo
Language:Inglês
Published: Elsevier 2016
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Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC4749891/
https://ncbi.nlm.nih.gov/pubmed/26937463
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.dib.2016.01.031
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