Lysozyme-in-water 1us full-atom GROMACS simulation for MDAnalysis parallelization benchmark
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下载链接：
https://zenodo.org/record/8349795
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资源简介：
I'm using trajectory and topology for an 1us run generated according to lysozyme in water tutorial and used later in this publication (charged HIS trajectory).
A full-atom xtc trajectory containing 25690 atoms in total (see topology for more detail).
Associated benchmark and its description can be found here.
创建时间：
2023-09-16
