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Balancing the Interactions of Mg(2+) in Aqueous Solution and with Nucleic Acid Moieties For a Polarizable Force Field Based on the Classical Drude Oscillator Model
Mg(2+) ions are important in biological systems, particularly in stabilizing compact RNA folds. Mg(2+) is strongly polarizing, and representing its interactions in heterogeneous environments is a challenge for empirical force field development. To date, the most commonly used force fields in molecul...
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| Published in: | J Phys Chem B |
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| Main Authors: | , |
| Format: | Artigo |
| Language: | Inglês |
| Published: |
2016
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| Subjects: | |
| Online Access: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5148688/ https://ncbi.nlm.nih.gov/pubmed/27759379 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.6b09262 |
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