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Ensuring scientific reproducibility in bio-macromolecular modeling via extensive, automated benchmarks.
Koehler Leman J, Lyskov S, Lewis SM, Adolf-Bryfogle J, Alford RF, Barlow K, Ben-Aharon Z, Farrell D, Fell J, Hansen WA, Harmalkar A, Jeliazkov J, Kuenze G, Krys JD, Ljubetič A, Loshbaugh AL, Maguire J, Moretti R, Mulligan VK, Nance ML, Nguyen PT, Ó Conchúir S, Roy Burman SS, Samanta R, Smith ST, Teets F, Tiemann JKS, Watkins A, Woods H, Yachnin BJ, Bahl CD, Bailey-Kellogg C, Baker D, Das R, DiMaio F, Khare SD, Kortemme T, Labonte JW, Lindorff-Larsen K, Meiler J, Schief W, Schueler-Furman O, Siegel JB, Stein A, Yarov-Yarovoy V, Kuhlman B, Leaver-Fay A, Gront D, Gray JJ, Bonneau R. Koehler Leman J, et al. Among authors: meiler j. Nat Commun. 2021 Nov 29;12(1):6947. doi: 10.1038/s41467-021-27222-7. Nat Commun. 2021. PMID: 34845212 Free PMC article.
Rapid protein fold determination using unassigned NMR data.
Meiler J, Baker D. Meiler J, et al. Proc Natl Acad Sci U S A. 2003 Dec 23;100(26):15404-9. doi: 10.1073/pnas.2434121100. Epub 2003 Dec 10. Proc Natl Acad Sci U S A. 2003. PMID: 14668443 Free PMC article.
Free modeling with Rosetta in CASP6.
Bradley P, Malmström L, Qian B, Schonbrun J, Chivian D, Kim DE, Meiler J, Misura KMS, Baker D. Bradley P, et al. Among authors: meiler j. Proteins. 2005;61 Suppl 7:128-134. doi: 10.1002/prot.20729. Proteins. 2005. PMID: 16187354
435 results