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. Author manuscript; available in PMC: 2022 Mar 9.
Published in final edited form as: J Chem Theory Comput. 2021 Feb 23;17(3):1581–1595. doi: 10.1021/acs.jctc.0c01327

Figure 4.

Figure 4.

(a) Chemical structure of ether lipids where R1 and R2 represent the acyl chains, atom notations follow CHARMM convention. (b) changes of partial charge in C36/LJPME relative to C36.