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Tidying up the conformational ensemble of a disordered peptide by computational prediction of spectroscopic fingerprints

The most advanced structure prediction methods are powerless in exploring the conformational ensemble of disordered peptides and proteins and for this reason the “protein folding problem” remains unsolved. We present a novel methodology that enables the accurate prediction of spectroscopic fingerpri...

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Detalles Bibliográficos
Autores principales: Michaelis, Monika, Cupellini, Lorenzo, Mensch, Carl, Perry, Carole C., Delle Piane, Massimo, Colombi Ciacchi, Lucio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10430726/
https://www.ncbi.nlm.nih.gov/pubmed/37592980
http://dx.doi.org/10.1039/d3sc02202a