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Per|Mut: Spatially Resolved Hydration Entropies from Atomistic Simulations
[Image: see text] The hydrophobic effect is essential for many biophysical phenomena and processes. It is governed by a fine-tuned balance between enthalpy and entropy contributions from the hydration shell. Whereas enthalpies can in principle be calculated from an atomistic simulation trajectory, c...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American
Chemical Society
2021
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8047778/ https://www.ncbi.nlm.nih.gov/pubmed/33710881 http://dx.doi.org/10.1021/acs.jctc.0c00961 |