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Generalized Born Implicit Solvent Models for Biomolecules

It would often be useful in computer simulations to use an implicit description of solvation effects, instead of explicitly representing the individual solvent molecules. Continuum dielectric models often work well in describing the thermodynamic aspects of aqueous solvation, and can be very efficie...

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Dades bibliogràfiques
Publicat a:Annu Rev Biophys
Autors principals: Onufriev, Alexey V., Case, David A.
Format: Artigo
Idioma:Inglês
Publicat: 2019
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC6645684/
https://ncbi.nlm.nih.gov/pubmed/30857399
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1146/annurev-biophys-052118-115325
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