Entropy and free energy of a mobile protein loop in explicit water.
Cheluvaraja S, Mihailescu M, Meirovitch H.
Cheluvaraja S, et al. Among authors: meirovitch h.
J Phys Chem B. 2008 Aug 7;112(31):9512-22. doi: 10.1021/jp801827f. Epub 2008 Jul 10.
J Phys Chem B. 2008.
PMID: 18613721
Free PMC article.
In previous studies HSMD (and HS Monte CarloHSMC) has been extended systematically to systems of increasing complexity, where the most recent is the seven-residue mobile loop, 304-310 (Gly-His-Gly-Ala-Gly-Gly-Ser) of the enzyme porcine pancreatic alpha-amylase modeled by the AMBE …
In previous studies HSMD (and HS Monte CarloHSMC) has been extended systematically to systems of increasing complexity, where the most recen …