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Implicit-solvent dissipative particle dynamics force field based on a four-to-one coarse-grained mapping scheme
A new set of efficient solvent-free dissipative particle dynamics (DPD) force fields was developed for phospholipids and peptides. To enhance transferability, this model maps around four heavy atoms and their connected hydrogen atoms into a coarse-grained elementary bead based on functional group. T...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Public Library of Science
2018
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5967728/ https://www.ncbi.nlm.nih.gov/pubmed/29795682 http://dx.doi.org/10.1371/journal.pone.0198049 |