Zobrazeno 1 - 4
of 4
pro vyhledávání: '"Justin M. Shorb"'
Publikováno v:
Journal of Chemical Education. 95:1922-1928
When used effectively, laboratory courses can be very important for enriching teaching and learning. However, a review of many colleges and universities across the nation reveals that around 50% of...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0f0899576271671186b8b07a601799b9
https://doi.org/10.1021/acs.jchemed.8b00140
https://doi.org/10.1021/acs.jchemed.8b00140
Publikováno v:
Biophysical Journal. 92(12):4168-4178
Molecular dynamics simulations were used to examine the structural dynamics of two fluorescent probes attached to a typical protein, hen egg-white lysozyme (HEWL). The donor probe (D) was attached via a succinimide group, consistent with the commonly
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9a9ca5229e40ee0f9f0901c83a434b77
Autor:
Robert E. Belford, John W. Moore, Harry E. Pence, Antony J. Williams, Omer Casher, Henry S. Rzepa, Robert M. Hanson, Martin A. Walker, B. Scott Williams, Laura E. Pence, Barbara Losoff, David J. Lubliner, Roberto Ma. Gregorius, Jonathan H. Chen, Matthew A. Kayala, Pierre Baldi, Janice Hall Tomasik, David Yaron, Michael Karabinos, Gaea Leinhardt, James Greeno, Jodi Davenport, Bruce McLaren, Laura Bartolo, John Portman, Colin Ashe, W. Craig Carter, Donald Sadoway, Ed Vitz, Justin M. Shorb, Barbara A. Reisner, Hilary J. Eppley, Margret J. Geselbracht, Elizabeth R. Jamieson, Adam R. Johnson, Sheila R. Smith, Joanne L. Stewart, Lori A. Watson
Publikováno v:
Journal of computational chemistry. 28(9)
We have explored the impact of a number of basic simulation parameters on the results of a recently developed hybrid molecular dynamics-quantum mechanics (MD-QM) method (Mercer et al., J Phys Chem B 1999, 103, 7720). The method utilizes MD simulation
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::6afe7a4fffa307cfa53635fa2c9f3211
https://pubmed.ncbi.nlm.nih.gov/17342706
https://pubmed.ncbi.nlm.nih.gov/17342706