Abstract:Molecular dynamics using atomistic modeling is frequently used to extract the mechanisms of macroion release from electrosprayed droplets. However, atomistic modeling is currently feasible for only the smallest window of droplet sizes that omits the droplet history. The relevance of the observations made in this narrow window to the actual droplet evolution has not been addressed. Here, we perform a systematic study of desolvation mechanisms of poly(ethylene glycol) (PEG), protonated peptides of different comp… Show more
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