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Accelerated Molecular Dynamics Applied to the Peptaibol Folding Problem
The use of enhanced sampling molecular dynamics simulations to facilitate the folding of proteins is a relatively new approach which has quickly gained momentum in recent years. Accelerated molecular dynamics (aMD) can elucidate the dynamic path from the unfolded state to the near-native state, “fla...
Autores principales: | Tyagi, Chetna, Marik, Tamás, Vágvölgyi, Csaba, Kredics, László, Ötvös, Ferenc |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6747184/ https://www.ncbi.nlm.nih.gov/pubmed/31480404 http://dx.doi.org/10.3390/ijms20174268 |
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