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ABACUS, a direct method for protein NMR structure computation via assembly of fragments.
Grishaev A, Steren CA, Wu B, Pineda-Lucena A, Arrowsmith C, Llinás M. Grishaev A, et al. Among authors: llinas m. Proteins. 2005 Oct 1;61(1):36-43. doi: 10.1002/prot.20457. Proteins. 2005. PMID: 16080153
The latter are obtained iteratively via Monte Carlo-Metropolis and/or probabilistic sequence selections, molecular dynamics structure computation and BACUS filtering (A. Grishaev and M. Llinas, J Biomol NMR 2004;28:1-10). ABACUS starts from scratch, without the requ …
The latter are obtained iteratively via Monte Carlo-Metropolis and/or probabilistic sequence selections, molecular dynamics structure comput …
Protein structure elucidation from NMR proton densities.
Grishaev A, Llinas M. Grishaev A, et al. Among authors: llinas m. Proc Natl Acad Sci U S A. 2002 May 14;99(10):6713-8. doi: 10.1073/pnas.042114399. Proc Natl Acad Sci U S A. 2002. PMID: 12011434 Free PMC article.
NMR solution structure of the neurotrypsin Kringle domain.
Ozhogina OA, Grishaev A, Bominaar EL, Patthy L, Trexler M, Llinás M. Ozhogina OA, et al. Among authors: llinas m. Biochemistry. 2008 Nov 25;47(47):12290-8. doi: 10.1021/bi800555z. Biochemistry. 2008. PMID: 18956887 Free PMC article.
328 results