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Continuous development of schemes for parallel computing of the electrostatics in biological systems: Implementation in DelPhi

Due to the enormous importance of electrostatics in molecular biology, calculating the electrostatic potential and corresponding energies has become a standard computational approach for the study of biomolecules and nano-objects immersed in water and salt phase or other media. However, the electros...

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Detalhes bibliográficos
Main Authors: Li, Chuan, Petukh, Marharyta, Li, Lin, Alexov, Emil
Formato: Artigo
Idioma:Inglês
Publicado em: 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3707979/
https://ncbi.nlm.nih.gov/pubmed/23733490
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.23340
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