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“Solvent hydrogen-bond occlusion”: a new model of polar desolvation for biomolecular energetics
Water engages in two important types of interactions near biomolecules: it forms ordered “cages” around exposed hydrophobic regions, and it participates in hydrogen bonds with surface polar groups. Both types of interaction are critical to biomolecular structure and function, but explicitly includin...
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| Publicado no: | J Comput Chem |
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| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2017
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5407913/ https://ncbi.nlm.nih.gov/pubmed/28318014 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.24740 |
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