MD simulation trajectory of POPE/DOG (18.75 mol%) bilayer and related files

<p>Simulation trajectory&nbsp;pre-equiblirated POPE/DOG bilayer and related files from all-atom molecular dynamics simulations. The system contains 18.75mol% DOG.&nbsp;Simulations have been performed with GROMACS-2021.2 with Lipid17 forcefield and TIP3P water model. The trajectory is 0-1000 ns, and we have disregarded the first 100 ns in our analysis.</p> <p>The system in the trajectory consists of 104&nbsp;POPE, 24&nbsp;DOG and 6400 water molecules. Temperature 310 K, pressure 1 bar.</p> <p>Publication:&nbsp;<a href="https://doi.org/10.1016/j.bbamem.2022.183961">https://doi.org/10.1016/j.bbamem.2022.183961</a></p>