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- W2610498315 abstract "Abstract : The general theory for investigating the conformational dynamics of nerve agents in solution by measuring transient protonproton nuclear Overhauser effect (NOE) build-up curves and the use of molecular dynamics simulations for their interpretation are explained. The phenemonon of nuclear magnetic relaxation is also described in some detail as well as how relaxation measurements can be interpreted with mathematical models of molecular motion and statistical distributions of correlation times to derive molecular dynamics information. Finally, examples of transient NOE measurements and their interpretation to determine an ensemble average conformation for VX in aqueous solution are summarized." @default.
- W2610498315 created "2017-05-12" @default.
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- W2610498315 date "2016-01-01" @default.
- W2610498315 modified "2023-09-28" @default.
- W2610498315 title "Using NMR Spectroscopy to Investigate the Solution Behavior of Nerve Agents and Their Binding to Acetylcholinesterase" @default.
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- W2610498315 doi "https://doi.org/10.21236/ad1001334" @default.
- W2610498315 hasPublicationYear "2016" @default.
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