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Conformational Ensembles by NMR and MD Simulations in Model Heptapeptides with Select Tri-Peptide Motifs

Both nuclear magnetic resonance (NMR) and molecular dynamics (MD) simulations are routinely used in understanding the conformational space sampled by peptides in the solution state. To investigate the role of single-residue change in the ensemble of conformations sampled by a set of heptapeptides, A...

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Detalles Bibliográficos
Autores principales:	Krishnan, V. V., Bentley, Timothy, Xiong, Alina, Maitra, Kalyani
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2021
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7866422/ https://www.ncbi.nlm.nih.gov/pubmed/33573010 http://dx.doi.org/10.3390/ijms22031364

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