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pro vyhledávání: '"Kathryn M. Lebold"'
Autor:
Kathryn M. Lebold, Robert B. Best
Publikováno v:
The journal of physical chemistry. B. 126(12)
The high concentration of nucleic acids and positively charged proteins in the cell nucleus provides many possibilities for complex coacervation. We consider a prototypical mixture of nucleic acids together with the polycationic C-terminus of histone
Autor:
Kathryn M. Lebold, Robert B. Best
Publikováno v:
Biophysical Journal. 121:23a
Autor:
Kathryn M. Lebold
Publikováno v:
Biophysical Journal. 118:225a-226a
Autor:
William G. Noid, Kathryn M. Lebold
Publikováno v:
The Journal of chemical physics. 151(16)
The dual-potential approach promises coarse-grained (CG) models that accurately reproduce both structural and energetic properties, while simultaneously providing predictive estimates for the temperature-dependence of the effective CG potentials. In
Autor:
William G. Noid, Kathryn M. Lebold
Publikováno v:
The Journal of chemical physics. 150(23)
Because they eliminate unnecessary degrees of freedom, coarse-grained (CG) models enable studies of phenomena that are intractable with more detailed models. For the same reason, the effective potentials that govern CG degrees of freedom incorporate
Autor:
William G. Noid, Kathryn M. Lebold
Publikováno v:
The Journal of chemical physics. 150(1)
Due to their computational efficiency, coarse-grained (CG) models are widely adopted for modeling soft materials. As a consequence of averaging over atomistic details, the effective potentials that govern the CG degrees of freedom vary with temperatu
Autor:
Kathryn M. Lebold, Michael R. DeLyser, Nicholas J.H. Dunn, William G. Noid, Joseph F. Rudzinski
Publikováno v:
The journal of physical chemistry. B. 122(13)
We present the BOCS toolkit as a suite of open source software tools for parametrizing bottom-up coarse-grained (CG) models to accurately reproduce structural and thermodynamic properties of high-resolution models. The BOCS toolkit complements availa
Autor:
Kathryn M. Lebold, Peter M. Findeis, James S. Swan, Berhane Temelso, George C. Shields, Sheena Hilton
Publikováno v:
International Journal of Mass Spectrometry. :25-32
A deprotonated 2-imidazoline-4(5)-one product ion was observed as a major fragment in the collision-induced dissociation (CID) of several dipeptides containing serine at the C-terminal and an amino acid with an alkyl substituent at the N-terminal. Th