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Molecular Dynamics Simulations of Macromolecular Crystals

The structures of biological macromolecules would not be known to their present extent without X-ray crystallography. Most simulations of globular proteins in solution begin by surrounding the crystal structure of the monomer in a bath of water molecules, but the standard simulation employing period...

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Podrobná bibliografie
Vydáno v:Wiley Interdiscip Rev Comput Mol Sci
Hlavní autoři: Cerutti, David S., Case, David A.
Médium: Artigo
Jazyk:Inglês
Vydáno: 2018
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC6818516/
https://ncbi.nlm.nih.gov/pubmed/31662799
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/wcms.1402
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