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Protein solvation from theory and simulation: Exact treatment of Coulomb interactions in three-dimensional theories
Solvation forces dominate protein structure and dynamics. Integral equation theories allow a rapid and accurate evaluation of the effect of solvent around a complex solute, without the sampling issues associated with simulations of explicit solvent molecules. Advances in integral equation theories m...
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| Main Authors: | , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Institute of Physics
2010
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2833187/ https://ncbi.nlm.nih.gov/pubmed/20151732 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.3299277 |
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