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. 2024 Oct 3;20(20):9190–9208. doi: 10.1021/acs.jctc.4c00868

Figure 10.

Figure 10

Entropy-enthalpy decompositions of DOPC-DPPC headgroup interactions for the DOPC/DPPC system. Standard errors at each r value are shown. Beads are labeled according to the following scheme. Choline: NC3, phosphate: PO4, glycerols: GL1 and GL2. Martini 3.0 decompositions (green) are compared to mapped CHARMM36 data (red).