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Exploring the Energy Landscapes of Cyclic Tetrapeptides with Discrete Path Sampling

[Image: see text] Cyclic tetrapeptides are an important class of biologically active molecules that exhibit interesting conformational dynamics, with slow interconversion of several different structures. We present calculations on their energy landscapes using discrete path sampling. In acyclic pept...

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Detalles Bibliográficos
Autores principales: Oakley, Mark T., Johnston, Roy L.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2012
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3624815/
https://www.ncbi.nlm.nih.gov/pubmed/23596359
http://dx.doi.org/10.1021/ct3005084