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Using DelPhi capabilities to mimic protein’s conformational reorganization with amino acid specific dielectric constants

Many molecular events are associated with small or large conformational changes occurring in the corresponding proteins. Modeling such changes is a challenge and requires significant amount of computing time. From point of view of electrostatics, these changes can be viewed as a reorganization of lo...

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Detalhes bibliográficos
Main Authors: Wang, Lin, Zhang, Zhe, Rocchia, Walter, Alexov, Emil
Formato: Artigo
Idioma:Inglês
Publicado em: 2012
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3966310/
https://ncbi.nlm.nih.gov/pubmed/24683422
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