Level-Set Variational Implicit-Solvent Modeling of Biomolecules with the Coulomb-Field Approximation

Central in the variational implicit-solvent model (VISM) [Dzubiella, Swanson, and McCammon Phys. Rev. Lett.2006, 96, 087802 and J. Chem. Phys.2006, 124, 084905] of molecular solvation is a mean-field free-energy functional of all possible solute–solvent interfaces or dielectric boundaries. Such a fu...

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Detalles Bibliográficos
Autores principales: Wang, Zhongming, Che, Jianwei, Cheng, Li-Tien, Dzubiella, Joachim, Li, Bo, McCammon, J. Andrew
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2011
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3278970/
https://www.ncbi.nlm.nih.gov/pubmed/22346739
http://dx.doi.org/10.1021/ct200647j

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3278970/
https://www.ncbi.nlm.nih.gov/pubmed/22346739
http://dx.doi.org/10.1021/ct200647j

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