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SHIFTX2: significantly improved protein chemical shift prediction

A new computer program, called SHIFTX2, is described which is capable of rapidly and accurately calculating diamagnetic (1)H, (13)C and (15)N chemical shifts from protein coordinate data. Compared to its predecessor (SHIFTX) and to other existing protein chemical shift prediction programs, SHIFTX2 i...

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Detalles Bibliográficos
Autores principales: Han, Beomsoo, Liu, Yifeng, Ginzinger, Simon W., Wishart, David S.
Formato: Texto
Lenguaje:English
Publicado: Springer Netherlands 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3085061/
https://www.ncbi.nlm.nih.gov/pubmed/21448735
http://dx.doi.org/10.1007/s10858-011-9478-4