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Building a macro-mixing dual-basin Gō model using the Multistate Bennett Acceptance Ratio

The dual-basin Gō-model is a structural-based coarsegrained model for simulating a conformational transition between two known structures of a protein. Two parameters are required to produce a dual-basin potential mixed using two single-basin potentials, although the determination of mixing paramete...

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Detalles Bibliográficos
Autores principales: Shinobu, Ai, Kobayashi, Chigusa, Matsunaga, Yasuhiro, Sugita, Yuji
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Biophysical Society of Japan (BSJ) 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6975896/
https://www.ncbi.nlm.nih.gov/pubmed/31984186
http://dx.doi.org/10.2142/biophysico.16.0_310