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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...
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| 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 |