Computational Modeling of the Thermodynamics of the Mesophilic and Thermophilic Mutants of Trp-Cage Miniprotein

[Image: see text] We characterize the folding–unfolding thermodynamics of two mutants of the miniprotein Trp-cage by combining extended molecular dynamics simulations and an advanced statistical–mechanical-based approach. From a set of molecular dynamics simulations in an explicit solvent performed...

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Detalles Bibliográficos
Autores principales: Bò, Leonardo, Milanetti, Edoardo, Chen, Cheng Giuseppe, Ruocco, Giancarlo, Amadei, Andrea, D’Abramo, Marco
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9088802/
https://www.ncbi.nlm.nih.gov/pubmed/35559192
http://dx.doi.org/10.1021/acsomega.1c06206

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9088802/
https://www.ncbi.nlm.nih.gov/pubmed/35559192
http://dx.doi.org/10.1021/acsomega.1c06206

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