All-Atom Molecular Dynamics Trajectories of Epidermicin NI01 in POPC/POPG Lipid Bilayers

This dataset contains molecular dynamics (MD) trajectories from three independent 2000 ns simulations of epidermicin NI01 embedded in POPC/POPG (3:1) lipid bilayers, along with a 2000 ns peptide-free membrane simulation. The simulations were performed using GROMACS with the CHARMM36m force field. All analyses were performed using the original trajectories. For data deposition, every tenth frame was retained using the GROMACS trjconv -skip 10 option.