Modulation of intra- and inter-sheet interactions in short peptide self-assembly by acetonitrile in aqueous solution

Deng Li¹, Zhao Yurong¹, Zhou Peng¹, Xu Hai^{1, †,}, Wang Yanting^{2, 3, ‡,}

Time evolutions of the RMSD with respect to the final configuration (a), radius of gyration (b), average inter-sheet distance (c), and hydrophobic area of the proto-fibril (d) in pure water.