遇见数据集

Martini water froze at 303 K

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NIAID Data Ecosystem2026-03-12 收录
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While doing some testing with Gromacs 2016 rc1, I managed to freeze Martini water boxes of 400 beads at 303.15 K; this happened with two independent initial configurations. I used the Martini Straight parameters. The simulation files, including trajectories (freezing occurs at 400 ns in system 1, at 325 ns in system 2), are available in this repository.

创建时间:
2020-12-31
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