MD_Data
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资源简介：
These files include all the required data such as input files, topology files etc., for the reproducibility of MD results. Output.zip file include the output data of 2nd and 3rd replica simulation. During the 2nd and 3rd replica simulation, Compounds 3 and 12 are abbreviated as "ATP" and "ITP", respectively.
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Zenodo创建时间：
2024-02-16
