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Adaptive Accelerated Molecular Dynamics (Ad-AMD) Revealing the Molecular Plasticity of P450cam
[Image: see text] An extended accelerated molecular dynamics (AMD) methodology called adaptive AMD is presented. Adaptive AMD (Ad-AMD) is an efficient and robust conformational space sampling algorithm that is particularly-well suited to proteins with highly structured potential energy surfaces exhi...
Autores principales: | Markwick, Phineus R. L., Pierce, Levi C. T., Goodin, David B., McCammon, J. Andrew |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2011
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3034398/ https://www.ncbi.nlm.nih.gov/pubmed/21307966 http://dx.doi.org/10.1021/jz101462n |
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