The interpretation of small molecule diffusion coefficients: Quantitative use of diffusion-ordered NMR spectroscopy

Abstract

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A global method for fast simulations of molecular dynamics in multiscale agent-based models of biological tissues

“…( de Pillis et al., 2005 , Evans, 2019 , Hao and Friedman, 2014 , Lai and Friedman, 2017 , Macklin et al., 2012 , McFadden and Kwok, 1988 , Mehrara et al., 2007 , Mihara et al., 2005 , Özbek et al., 1998 , Prokić and Pučar, 1979 , Talkington and Durrett, 2015 , Tan et al., 2018 , Zhao et al., 2010 ; Filion and Popel, 2004 ).…”

Molar mass effect in food and health

“… De Silva et al, 2013 ; Draget et al, 1991 ; Enright and Leitner, 2005 ; Evans, 2019 ; Funami et al, 2008a ; Funami et al, 2008b ; Garcia et al, 2017 ; Gidley and Nishinari, 2009 ; Lapis et al, 2016 ; Lombry et al, 2000 ; Luo et al, 2017 ; Moritaka et al, 2019 ; Shishir et al, 2018 ; Tomasetti et al, 2017 ; Turcanu et al, 2015 ; Zhang et al, 2017 ; Gao et al 2009 ; Kawai, 2012 .…”

1H Diffusion-Ordered Nuclear Magnetic Resonance Spectroscopic Analysis of Water-Extractable Arabinoxylan in Wheat (Triticum aestivum L.) Flour

“…Self-diffusion is a mode of mass transport that depends on the size and shape of molecular species, driven by thermal energy and random particle collisions. 26 Chemical species varying in molecular size and shape can be distinguished from each other based on their diffusion coefficient (Stejskal-Tanner equation). 27 In combination with raTe of relaxation Ordered SpectroscopY (TOSY), distinct subpopulations were identified in a mixture of AX oligosaccharides (AXOS).…”

“…Vaneeckhaute et al have recently demonstrated the potential of diffusion-ordered NMR spectroscopy (DOSY) to discriminate between AX oligosaccharides based on their self-diffusion properties. Self-diffusion is a mode of mass transport that depends on the size and shape of molecular species, driven by thermal energy and random particle collisions . Chemical species varying in molecular size and shape can be distinguished from each other based on their diffusion coefficient (Stejskal–Tanner equation) .…”