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Normal mode analysis calculation for a full-atom model with a smaller number of degrees of freedom for huge protein molecules

The number of degrees of freedom (DOF), N, in normal mode analysis (NMA) calculations of proteins is a crucial problem in huge systems because the eigenvalue problem of an N-by-N matrix must be solved. If it were possible to perform the analysis with a smaller number of DOF for the same system with...

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Detalhes bibliográficos
Publicado no:Biophys Physicobiol
Main Authors: Endo, Shigeru, Wako, Hiroshi
Formato: Artigo
Idioma:Inglês
Publicado em: The Biophysical Society of Japan (BSJ) 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6975923/
https://ncbi.nlm.nih.gov/pubmed/31984173
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.2142/biophysico.16.0_205
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