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Comprehensive Peptide Ion Structure Studies Using Ion Mobility Techniques: Part 3. Relating Solution-phase to Gas-phase Structures
Molecular dynamics (MD) simulations have been utilized to study peptide ion conformer establishment during the electrospray process. An explicit water model is used for nanodroplets containing a model peptide and hydronium ions. Simulations are conducted at 300 K for two different peptide ion charge...
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| Publicat a: | J Am Soc Mass Spectrom |
|---|---|
| Autors principals: | , , |
| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
2018
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6525623/ https://ncbi.nlm.nih.gov/pubmed/29858839 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s13361-018-1996-9 |
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