Zobrazeno 1 - 10
of 65
pro vyhledávání: '"Scott H. Northrup"'
Autor:
Scott H. Northrup
Publikováno v:
Protein Electron Transfer ISBN: 9781003076803
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ea74716b7ebf89ae68abb647f40c301a
https://doi.org/10.1201/9781003076803-4
https://doi.org/10.1201/9781003076803-4
Publikováno v:
Journal of Analytical and Applied Pyrolysis. 134:43-51
Molecular-scale modeling was used to estimate the diffusion coefficient for CO2 in crystalline and amorphous cellulose. Using the molecular mechanics force field, PCFF, molecular dynamics simulations were performed on CO2-cellulose systems at tempera
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::abd18073888c151c710e31e9ea86aeaa
https://doi.org/10.1016/j.jaap.2018.05.005
https://doi.org/10.1016/j.jaap.2018.05.005
Publikováno v:
Journal of Materials Science. 52:13719-13735
Most concrete produced includes chemical admixtures such as air entrainers, set modifiers, water reducers, etc., many of which include organic molecules. Hydroxycarboxylic acids, in particular, retard portland cement hydration. The interaction of suc
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5e5041a5714bc33a6f77703cab2cff27
https://doi.org/10.1007/s10853-017-1464-0
https://doi.org/10.1007/s10853-017-1464-0
Publikováno v:
Journal of the American Ceramic Society. 100:4999-5010
This study summarizes molecular dynamics (MD) simulations and experiments using four ester-based cement shrinkage reducing agents (SRa) in pure water and simulated cement pore solution. The esters were found to completely dissociate in the alkaline p
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8b1eb3dcf27482a4dc9fc210359534e4
https://doi.org/10.1111/jace.14988
https://doi.org/10.1111/jace.14988
Publikováno v:
Computational and Theoretical Chemistry. 1088:9-23
Six organophosphate pesticides of high to moderate toxicity (dichlorvos (DCV), dicrotophos (DTP), ethoprophos (EPP), methamidophos (MAP), mevinphos (MVP) and omethoate (OMT)) are computationally studied to determine their structure and up to 12 diffe
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8145c8c2b31371a46c64115d9e918f91
https://doi.org/10.1016/j.comptc.2016.04.024
https://doi.org/10.1016/j.comptc.2016.04.024
Autor:
Sireesha Kollipara, Shivakishore Tatireddy, Thusitha Pathirathne, Scott H. Northrup, Lasantha K. Rathnayake
Publikováno v:
The Journal of Physical Chemistry B. 120:8193-8207
Brownian dynamics (BD) simulations provide here a theoretical atomic-level treatment of the reduction of human ferric cytochrome b5 (cyt b5) by NADH-cytochrome b5 reductaste (cyt b5r) and several of its mutants. BD is used to calculate the second-ord
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7eaab9fbeea01e86987b5843af382f92
https://doi.org/10.1021/acs.jpcb.6b01726
https://doi.org/10.1021/acs.jpcb.6b01726
Publikováno v:
AIChE Journal. 61:2562-2570
Thermochemical conversion of lignocellulosic biomass to renewable fuels and chemicals occurs through high temperature decomposition of the main structural components in plants, including cellulose, hemicellulose, and lignin. Cellulose and hemicellulo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::225cd22dd3b4e5e2d59910d181473211
https://doi.org/10.1002/aic.14854
https://doi.org/10.1002/aic.14854
Publikováno v:
Brazilian Journal of Chemical Engineering v.34 n.1 2017
Brazilian Journal of Chemical Engineering
Associação Brasileira de Engenharia Química (ABEQ)
instacron:ABEQ
Brazilian Journal of Chemical Engineering, Volume: 34, Issue: 1, Pages: 1-18, Published: JAN 2017
Brazilian Journal of Chemical Engineering, Vol 34, Iss 1, Pp 1-18
Brazilian Journal of Chemical Engineering
Associação Brasileira de Engenharia Química (ABEQ)
instacron:ABEQ
Brazilian Journal of Chemical Engineering, Volume: 34, Issue: 1, Pages: 1-18, Published: JAN 2017
Brazilian Journal of Chemical Engineering, Vol 34, Iss 1, Pp 1-18
Decades of classical research on pyrolysis of lignocellulosic biomass has not yet produced a generalized formalism for design and prediction of reactor performance. Plagued by the limitations of experimental techniques such as thermogravimetric analy
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::94edaba1eac7576c8ee8b92bf708a160
http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0104-66322017000100001
http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0104-66322017000100001
Autor:
Kathryn A. Thomasson, Scott H. Northrup, Thea Kaldor, Tamara Baumgartner, Jennifer Czlapinski, Igor V. Ouporov
Publikováno v:
The Journal of Physical Chemistry B. 101:9127-9136
The Brownian dynamics (BD) simulation method has been employed to study the energetics of nonspecific binding of λ Cro repressor protein (Cro) to model B-DNA. BD simulates the diffusional dynamics as the protein encounters the DNA surface and descri
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7ca02bdbce5168fa272a35e577cb5d09
https://doi.org/10.1021/jp971924k
https://doi.org/10.1021/jp971924k
Autor:
Scott H. Northrup
Publikováno v:
Current Opinion in Structural Biology. 4:269-274
Advances in the theory and simulation of the hydrodynamic motion of large biological molecules have been made in three major areas. The first of these is the important connection between the diffusive motion of molecules and their biochemical reactio
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f8e5e2775606a4f0aa682120fd25b28f
https://doi.org/10.1016/s0959-440x(94)90319-0
https://doi.org/10.1016/s0959-440x(94)90319-0