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On the Utilization of Energy Minimization to the Study of Ion Selectivity
The major pitfalls in studying ion selectivity in binding site models using energy minimization based methods are examined and discussed. It is shown that the properties derived from energy minimization are strongly configuration-dependent and that the results should be interpreted with caution. It...
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| Главные авторы: | , |
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| Формат: | Artigo |
| Язык: | Inglês |
| Опубликовано: |
The Biophysical Society
2009
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| Предметы: | |
| Online-ссылка: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2764064/ https://ncbi.nlm.nih.gov/pubmed/19843443 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2009.08.005 |
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