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Optimization of Protein Backbone Dihedral Angles by Means of Hamiltonian Reweighting
[Image: see text] Molecular dynamics simulations depend critically on the accuracy of the underlying force fields in properly representing biomolecules. Hence, it is crucial to validate the force-field parameter sets in this respect. In the context of the GROMOS force field, this is usually achieved...
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| Опубликовано в: : | J Chem Inf Model |
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| Главные авторы: | , |
| Формат: | Artigo |
| Язык: | Inglês |
| Опубликовано: |
American Chemical
Society
2016
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| Online-ссылка: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5039763/ https://ncbi.nlm.nih.gov/pubmed/27559757 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.6b00399 |
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