Atomistic molecular dynamics simulations are used to predict 1H NMR T1 relaxation of water from paramagnetic Gd3+ ions in solution at 25oC. Simulations of the T1 relaxivity dispersion function r1...
Gadolinium-based contrast agents are key in clinical MRI for enhancing the longitudinal NMR relativity (r1) of hydrogen nuclei (1H) in water and improving the contrast among different tissues. The importance...
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