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Polarizable Mean-Field Model of Water for Biological Simulations with Amber and Charmm force fields
Although a great number of computational models of water are available today, the majority of current biological simulations are done with simple models, such as TIP3P and SPC, developed almost thirty years ago and only slightly modified since then. The reason is that the non-polarizable force field...
Gorde:
| Argitaratua izan da: | J Chem Theory Comput |
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| Egile Nagusiak: | , |
| Formatua: | Artigo |
| Hizkuntza: | Inglês |
| Argitaratua: |
2012
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| Gaiak: | |
| Sarrera elektronikoa: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4285689/ https://ncbi.nlm.nih.gov/pubmed/25580096 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct300011h |
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