
This repository includes all input structures, NAMD configuration files, and output coordinates/trajectories for a set of simulations investigating the lipid transport by LetAB. LetAB_MD_Simulations_Zenodo_Reduced.zip contains only the atmoic coordinates in the first and last frame of simulations, while LetAB_MD_Simulations_Zenodo_Full.zip contains full simulation trajectories. Recommended software to use is VMD for visualization and NAMD for MD simulations.
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